smiles_to_cid.json

{"CCCC=O": "mobley_8573194", "CC(=C)c1ccccc1": "mobley_3746675", "CC(C)OC": "mobley_3269565", "CCc1ccc(cc1)O": "mobley_2923700", "c1cc2ccc3cccc4c3c2c(c1)cc4": "mobley_2577969", "c1cc2c(cc1Cl)Oc3c(c(c(c(c3Cl)Cl)Cl)Cl)O2": "mobley_3976574", "Cc1c[nH]c2c1cccc2": "mobley_1821184", "CCCCCC#C": "mobley_49274", "CC(=O)C1CC1": "mobley_197466", "Cc1cccc(c1C)C": "mobley_3452749", "NN": "mobley_7261305", "CCCCCCCCN": "mobley_6248915", "CC1CCC(CC1)C": "mobley_9139060", "COCOC": "mobley_3083321", "c1c(cc(c(c1Cl)Cl)Cl)c2cc(c(c(c2Cl)Cl)Cl)Cl": "mobley_3269819", "CC1(Cc2cccc(c2O1)OC(=O)NC)C": "mobley_6620221", "C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O)O)O)O)O": "mobley_9534740", "c1ccc2c(c1)C(=O)NC2=O": "mobley_2782339", "c1ccc(cc1)CCO": "mobley_1858644", "c1ccc2c(c1)Cc3ccccc3C2": "mobley_2972345", "c1cc(ccc1O)F": "mobley_852937", "CCCCCCN": "mobley_6060301", "C(C(F)(F)F)O": "mobley_3006808", "COc1c(ccc(c1C(=O)O)Cl)Cl": "mobley_5708811", "c1c(c(=O)[nH]c(=O)[nH]1)C(F)(F)F": "mobley_7794077", "CCC=C": "mobley_1662128", "COC(CC#N)(OC)OC": "mobley_8789864", "C1CCC(C1)O": "mobley_8899867", "CCCCCCC": "mobley_8614858", "CCCC(=O)O": "mobley_820789", "Cc1ccccc1O": "mobley_4035953", "C1CCNC1": "mobley_646007", "CCCCCC(=O)OC": "mobley_1017962", "COC(CCl)(OC)OC": "mobley_3589456", "CCCCC(=O)O": "mobley_4792268", "COC(=O)c1ccccc1": "mobley_3968739", "CCl": "mobley_4434915", "c1c(c(=O)[nH]c(=O)[nH]1)I": "mobley_2727678", "CCCCN(CC)C(=O)SCCC": "mobley_1352110", "CCOC=O": "mobley_2294995", "c1ccc2c(c1)C(=O)c3c(ccc(c3C2=O)O)N": "mobley_4371692", "c1ccc2c(c1)cccc2N": "mobley_3843583", "CCCCOCCO": "mobley_5880265", "[C@@H](C(F)(F)F)(Cl)Br": "mobley_4506634", "c1c(c(=O)[nH]c(=O)[nH]1)F": "mobley_337666", "CC(C)C(C)C": "mobley_4561957", "CCCCCCCCCC(=O)C": "mobley_7375018", "COc1cccc(c1)N": "mobley_755351", "C(C(Cl)(Cl)Cl)(Cl)(Cl)Cl": "mobley_1278715", "CC(=C)C": "mobley_299266", "Cc1ccc(cc1)C=O": "mobley_6175884", "CCC(=O)Nc1ccc(c(c1)Cl)Cl": "mobley_7463408", "COS(=O)(=O)OC": "mobley_5760563", "c1ccc(c(c1)O)I": "mobley_8789465", "C[C@@H](c1cccc(c1)C(=O)c2ccccc2)C(=O)O": "mobley_2099370", "C(F)Cl": "mobley_3425174", "CCCCCC(=O)C": "mobley_3573480", "CC(C)CO": "mobley_2245668", "c1cc(c(cc1c2cc(c(c(c2Cl)Cl)Cl)Cl)Cl)Cl": "mobley_1034539", "c1cc2c(cc1Cl)Oc3cc(c(c(c3O2)Cl)Cl)Cl": "mobley_2844990", "CC1=CC(=O)CC(C1)(C)C": "mobley_7364468", "C[C@@H](CO[N+](=O)[O-])O[N+](=O)[O-]": "mobley_3210206", "CCCCCCCCl": "mobley_7157427", "CCCCCCCl": "mobley_1893937", "CN(C)CCC=C1c2ccccc2CCc3c1cccc3": "mobley_5282042", "c1ccc(c(c1)C=O)O": "mobley_2850833", "CCCC/C=C/C": "mobley_8467917", "c1c(c(=O)[nH]c(=O)[nH]1)Cl": "mobley_9557440", "CCCS": "mobley_186894", "c1c2c(cc(c1Cl)Cl)Oc3c(c(c(c(c3Cl)Cl)Cl)Cl)O2": "mobley_2960202", "CN(C)C(=O)c1ccccc1": "mobley_4188615", "CC(=O)O": "mobley_3034976", "COC(C(F)(F)F)(OC)OC": "mobley_7360181", "CCCCC#C": "mobley_1674094", "Cc1ccc(cc1)C": "mobley_3234716", "COc1ccc(cc1)N": "mobley_4218209", "c1cc(cc(c1)Cl)O": "mobley_8057732", "COc1ccccc1OC": "mobley_2613240", "CC(=C)C(=C)C": "mobley_900088", "COC(=O)C1CC1": "mobley_4620651", "CC[C@@H](C)c1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-]": "mobley_3274817", "CCCC": "mobley_1923244", "c1ccc(cc1)F": "mobley_4483973", "COC(=O)c1ccc(cc1)O": "mobley_2295058", "CCCN": "mobley_9185328", "CCCCC(=O)CCCC": "mobley_3318135", "c1cc(ccc1[N+](=O)[O-])O": "mobley_2751110", "C/C=C/C=O": "mobley_6497672", "CCS": "mobley_1800170", "c1c(c(=O)[nH]c(=O)[nH]1)Br": "mobley_4039055", "Cc1cc(c2ccccc2c1)C": "mobley_5665561", "CC(=O)c1ccccc1": "mobley_7497999", "CCCc1ccccc1": "mobley_6430250", "CCCCC=O": "mobley_8492526", "CC(C)CO[N+](=O)[O-]": "mobley_2881590", "C(CCl)Cl": "mobley_1857976", "c1ccncc1": "mobley_296847", "C(F)(F)Cl": "mobley_8311321", "Cc1ccc2cc(ccc2c1)C": "mobley_5110043", "C[N+](=O)[O-]": "mobley_1952272", "CC(=O)OCC(COC(=O)C)OC(=O)C": "mobley_6198745", "CCCCCCCC": "mobley_3167746", "CCc1ccncc1": "mobley_6303022", "CCC[C@@H](C)O": "mobley_2864987", "CCCC#C": "mobley_430089", "CCCCOC(=O)C": "mobley_2364370", "COc1ccccc1N": "mobley_5072416", "C1CCCC1": "mobley_8006582", "C(CO)O": "mobley_4639255", "C(=C\\Cl)\\Cl": "mobley_4465023", "COCCO": "mobley_5816127", "C[C@@H]1CCCC[C@@H]1C": "mobley_4715906", "CCCCCCCC=C": "mobley_3709920", "CCOC(=O)CCC(=O)OCC": "mobley_1743409", "C[C@@H]1CC[C@H](C(=O)C1)C(C)C": "mobley_5616693", "CCOC": "mobley_6911232", "Cc1cccc(n1)C": "mobley_4584540", "c1c(cc(c(c1Cl)Cl)Cl)Cl": "mobley_1855337", "CCCCCCCI": "mobley_4759887", "Cc1ccc(c2c1cccc2)C": "mobley_3715043", "Cc1ccccc1N": "mobley_3187514", "C(CBr)Cl": "mobley_7768165", "C1C=CC=CC=C1": "mobley_9729792", "CC(C)(/C=N\\OC(=O)NC)SC": "mobley_5200358", "COc1cccc(c1)O": "mobley_2457863", "c1ccc(cc1)C(F)(F)F": "mobley_8809274", "CCCC(=O)OC": "mobley_5390332", "CCCCCCCC(=O)C": "mobley_1502181", "c1cc(cc(c1)C(F)(F)F)C(F)(F)F": "mobley_4678740", "CCCCCC(=O)OCC": "mobley_1592519", "CC(C)(C)C(=O)OC": "mobley_1781152", "CC(C)c1ccccc1": "mobley_5445548", "CC(=O)C": "mobley_3867265", "CCCCCOC(=O)CC": "mobley_3572203", "CCCc1ccc(c(c1)OC)O": "mobley_3359593", "CCOP(=O)(OCC)O/C(=C/Cl)/c1ccc(cc1Cl)Cl": "mobley_6522117", "c1cc(c(cc1c2c(c(cc(c2Cl)Cl)Cl)Cl)Cl)Cl": "mobley_8311303", "CC(C)SC(C)C": "mobley_9974966", "CCCN(CCC)C(=O)SCCC": "mobley_8713762", "COc1ccc(cc1)C(=O)OC": "mobley_7393673", "CC(=O)CO[N+](=O)[O-]": "mobley_4964807", "CN(C)c1ccccc1": "mobley_5326154", "c1ccc(c(c1)O)F": "mobley_7200804", "C(F)(F)(F)Br": "mobley_7732703", "c1ccc(cc1)c2cc(c(c(c2Cl)Cl)Cl)Cl": "mobley_9510785", "c1ccc2c(c1)C(=O)c3cccc(c3C2=O)NCCO": "mobley_2316618", "CCC[N+](=O)[O-]": "mobley_9671033", "CCCCCCBr": "mobley_929676", "CCCCCCCCBr": "mobley_9015240", "CCC(C)(C)O": "mobley_9838013", "CC[C@@H](C)C(C)C": "mobley_8668219", "CCCl": "mobley_2198613", "CCCC(=O)OCC": "mobley_1722522", "CC(C)CCO": "mobley_5973402", "CCCOCCC": "mobley_7542832", "Cc1ccc(cc1)C(=O)N(C)C": "mobley_2659552", "CCCCCCCCO": "mobley_36119", "CN(C)C(=O)Nc1ccccc1": "mobley_6861308", "CC(OC(=O)C)OC(=O)C": "mobley_4463913", "c1c2c(cc(c1Cl)Cl)Oc3cc(c(cc3O2)Cl)Cl": "mobley_2845466", "CC/C=C\\C": "mobley_9112978", "CCCC(=O)C": "mobley_1881249", "CCCC[C@@H](C)CC": "mobley_6896128", "CCCO": "mobley_313406", "CS(=O)(=O)Cl": "mobley_4850657", "CCCCC(=O)C": "mobley_2487143", "CC[C@H](C)Cl": "mobley_6235784", "C(CCCl)CCl": "mobley_5286200", "CCCC=C": "mobley_4043951", "Cc1cccc(c1N)C": "mobley_5571660", "CCCCCCCCCO": "mobley_3378420", "CCOCCO": "mobley_9626434", "CCOC(=O)CC(=O)OCC": "mobley_2402487", "CC(C)CCOC(=O)C": "mobley_5471704", "CCOc1ccccc1": "mobley_2763835", "CCCC1CCCC1": "mobley_6416775", "C(I)I": "mobley_664966", "C(C(Cl)(Cl)Cl)Cl": "mobley_1893815", "c1(c(c(c(c(c1Cl)Cl)Cl)Cl)Cl)c2c(c(c(c(c2Cl)Cl)Cl)Cl)Cl": "mobley_5456566", "COC(c1ccccc1)(OC)OC": "mobley_3325209", "Cc1cccc(c1C)Nc2ccccc2C(=O)O": "mobley_4936555", "c1cc(c(c(c1)Cl)c2c(cccc2Cl)Cl)Cl": "mobley_628951", "CC(C)(C)c1ccc(cc1)O": "mobley_5467162", "CCNc1nc(nc(n1)Cl)NCC": "mobley_8207196", "CC(C)Cl": "mobley_1231151", "c1ccc(cc1)c2ccccc2Cl": "mobley_9717937", "CCSSCC": "mobley_590519", "C(Cl)Cl": "mobley_3762186", "CCCCS": "mobley_1563176", "CCOC(=O)C": "mobley_6973347", "CC(OC)(OC)OC": "mobley_550662", "CC(C)C(=O)C(C)C": "mobley_4013838", "Cn1cnc2c1c(=O)n(c(=O)n2C)C": "mobley_7378987", "COC(OC)OC": "mobley_2279874", "CCOC(OCC)Oc1ccccc1": "mobley_4934872", "COS(=O)(=O)C": "mobley_9201263", "C1CC=CC1": "mobley_8885088", "C([C@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)O": "mobley_4587267", "CCOC(=O)C[C@H](C(=O)OCC)SP(=S)(OC)OC": "mobley_8916409", "CN1CCCCC1": "mobley_63712", "c1cc2c(cc1Cl)Oc3ccc(cc3O2)Cl": "mobley_4149784", "CC#C": "mobley_8260524", "COCC(OC)(OC)OC": "mobley_5747981", "c1ccc(cc1)c2ccccc2": "mobley_2005792", "CCCC(C)(C)C": "mobley_252413", "CC1=CCCCC1": "mobley_6571751", "CCCCCCCO": "mobley_5079234", "c1cc(ccc1O)Br": "mobley_1733799", "CCCI": "mobley_1199854", "CCC[C@H](CC)O": "mobley_7977115", "CC(C)CBr": "mobley_627267", "COc1c(cc(c(c1O)OC)Cl)Cl": "mobley_6688723", "CCCCCI": "mobley_8525830", "C1=C[C@@H]([C@@H]2[C@H]1[C@@]3(C(=C([C@]2(C3(Cl)Cl)Cl)Cl)Cl)Cl)Cl": "mobley_468867", "CCCCC=C": "mobley_5310099", "c1ccc2c(c1)C(=O)c3cccc(c3C2=O)N": "mobley_8052240", "CC=C(C)C": "mobley_778352", "c1ccc(c(c1)Cl)Cl": "mobley_2489709", "c1ccc(c(c1)N)Cl": "mobley_3169935", "C(CO[N+](=O)[O-])O[N+](=O)[O-]": "mobley_52782", "Cc1ccc(cc1)N": "mobley_5518547", "c12c(c(c(c(c1Cl)Cl)Cl)Cl)Oc3c(c(c(c(c3Cl)Cl)Cl)Cl)O2": "mobley_9821936", "Cc1ccncc1C": "mobley_2371092", "Cc1cc(ccc1Cl)O": "mobley_4395315", "COCCN": "mobley_6917738", "CN1CCOCC1": "mobley_8558116", "c1cnccc1C=O": "mobley_8798016", "S": "mobley_1929982", "CCSC": "mobley_2049967", "C1[C@H]([C@@H]2[C@H]([C@H]1Cl)[C@]3(C(=C([C@@]2(C3(Cl)Cl)Cl)Cl)Cl)Cl)Cl": "mobley_6733657", "CCC(=O)OC": "mobley_1075836", "CCC#C": "mobley_9121449", "c1c(=O)[nH]c(=O)[nH]c1Cl": "mobley_4338603", "C1CCC=CC1": "mobley_3211679", "c1ccc2c(c1)Oc3cccc(c3O2)Cl": "mobley_7239499", "COc1c(c(c(c(c1Cl)C=O)Cl)OC)O": "mobley_6195751", "Cc1cc2ccccc2cc1C": "mobley_547634", "CCCC(=O)OCCC": "mobley_3690931", "CN(C)C": "mobley_9209581", "c1cc(c(c(c1Cl)Cl)Cl)Cl": "mobley_4219614", "CC(C)CC(=O)O": "mobley_2929847", "CC(=O)C1CCCCC1": "mobley_2043882", "COc1ccccc1O": "mobley_3515580", "CCCCCC(=O)O": "mobley_1735893", "CCN": "mobley_2410897", "c1ccc(cc1)n2c(=O)c(c(cn2)N)Cl": "mobley_2523689", "c1cc(c(c(c1)Cl)C#N)Cl": "mobley_9740891", "CCCCCCc1ccccc1": "mobley_588781", "CC(C)CCC(C)(C)C": "mobley_3060426", "c1ccc(cc1)O[C@@H](C(F)F)F": "mobley_6843802", "C1COCCO1": "mobley_6739648", "c1cc(cc(c1)Cl)Cl": "mobley_1079207", "C(=C/Cl)\\Cl": "mobley_9913368", "C1[C@H]([C@@H]([C@H]([C@H](O1)O)O)O)O": "mobley_1896013", "Cc1ccnc(c1)C": "mobley_8861672", "CCCC(C)(C)O": "mobley_3414356", "CN(C)CCOC(c1ccccc1)c2ccccc2": "mobley_1944394", "c1ccc(cc1)OC=O": "mobley_1046331", "CCC(=O)O": "mobley_7758918", "c1ccc(cc1)CCCO": "mobley_7463799", "CCCCCCC=O": "mobley_7859387", "C1CCC(=O)C1": "mobley_3968043", "COP(=S)(OC)SCn1c(=O)c2ccccc2nn1": "mobley_1770205", "CCCCCCCCC=O": "mobley_1976156", "CC#N": "mobley_7532833", "CCCCCCO[N+](=O)[O-]": "mobley_3802803", "N": "mobley_5631798", "c1cc(cc(c1)O)[N+](=O)[O-]": "mobley_7176290", "Cc1ccc(cc1)C(=O)C": "mobley_349850", "CC(C)(C)O": "mobley_1650157", "C1CNC1": "mobley_6266306", "CC[C@H](C)c1ccccc1": "mobley_2183616", "CCCCCCCCC": "mobley_4375719", "CCc1cccnc1": "mobley_4884177", "Cc1ccc(cc1)Br": "mobley_4494568", "COC(=O)C1CCCCC1": "mobley_6978427", "CC(C)(C)Cl": "mobley_7047032", "Cc1ccccc1": "mobley_1873346", "C": "mobley_9055303", "c1ccc2c(c1)CCC2": "mobley_5094777", "COC=O": "mobley_1717215", "CCC": "mobley_2068538", "CC(Cl)Cl": "mobley_3999471", "C1=CC(=O)C=CC1=O": "mobley_3727287", "CN(C)C(=O)c1ccc(cc1)OC": "mobley_5600967", "C1CCC(=O)CC1": "mobley_3682850", "CC1=CC[C@H](C[C@@H]1O)C(=C)C": "mobley_9653690", "C(CBr)Br": "mobley_1792062", "CCCC[N+](=O)[O-]": "mobley_6006813", "c1cc(cc(c1)[N+](=O)[O-])N": "mobley_3777264", "CC(C)(C)C": "mobley_1261349", "COc1cccc(c1O)OC": "mobley_486214", "C(Br)Br": "mobley_9246351", "C1COCCN1": "mobley_1659169", "CC(C)CC(=O)C": "mobley_8337977", "CCCCOCCCC": "mobley_129464", "CC(=O)NC": "mobley_1963873", "C(C(F)(Cl)Cl)(F)(F)Cl": "mobley_1838110", "CCOP(=S)(OCC)SCSP(=S)(OCC)OCC": "mobley_7754849", "CCN(CC)CC": "mobley_8449031", "CCC(C)(C)CC": "mobley_2609604", "c1ccc2c(c1)C(=O)c3c(ccc(c3C2=O)N)N": "mobley_242480", "C(=C(F)F)(C(F)(F)F)F": "mobley_5494918", "CC(C)COC(=O)C(C)C": "mobley_6456034", "CN(CC(F)(F)F)c1ccccc1": "mobley_3266352", "[C@@H](C(F)(F)F)(OC(F)F)Cl": "mobley_2023925", "CCC(C)C": "mobley_1803862", "CCCCCCCC(=O)OC": "mobley_7608435", "CCC(=O)N": "mobley_8427539", "Cc1ccccc1Cl": "mobley_1760914", "Cc1c(c(=O)n(c(=O)[nH]1)C(C)(C)C)Cl": "mobley_3105103", "CCCOCCO": "mobley_4687447", "c1ccc(c(c1)[N+](=O)[O-])O": "mobley_5063386", "C(C(CO)O)O": "mobley_3259411", "C[C@@H]1CC[C@H](CC1=O)C(=C)C": "mobley_1160109", "Cc1cccc(c1)O": "mobley_8691603", "c1ccc2c(c1)ccc3c2cccc3": "mobley_7017274", "C1CCOCC1": "mobley_3395921", "CCOCCOCC": 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