Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 2068459
MolClass #15001
FLEAYDDSSZOIRT-UHFFFAOYSA-N
- 1985648
MolClass #15002
HYLMYFDECMONAU-UHFFFAOYSA-N
- 1978866
MolClass #15003
LBLKLFVDWGFEKY-UHFFFAOYSA-N
- 1784512
MolClass #15004
JSLZGPONLCARCK-UHFFFAOYSA-N
- 1983120
MolClass #15005
XJSFANPLCWXPHP-UHFFFAOYSA-N
- 2066806
MolClass #15006
QMZGDBQGSICJCQ-UHFFFAOYSA-N
- 3034088
MolClass #15007
- 1912261
MolClass #15008
QDXHANXUOOBFBZ-UHFFFAOYSA-N
- 2062394
MolClass #15009
- 2074805
MolClass #15010
WLGMOXHXQGODFR-UHFFFAOYSA-N
- 1919940
MolClass #15011
- 1985216
MolClass #15012
- 1983637
MolClass #15013
- 1988691
MolClass #15014
XMDMJVAPVXLBHJ-UHFFFAOYSA-N
- 2061577
MolClass #15015
VOYWPIBETOKMRW-UHFFFAOYSA-N
- 1489761
MolClass #15016
MMVCUDIQVWIEQW-UHFFFAOYSA-N
- 1359490
MolClass #15017
YSYZPUGFDPVCEJ-UHFFFAOYSA-N
- 3034685
MolClass #15018
YCTVCUNHDBBUHT-UHFFFAOYSA-N
- 1911784
MolClass #15019
DSESJTDYBTVWQY-UHFFFAOYSA-N
- 1983510
MolClass #15020
- 3043809
MolClass #15021
OTROWFOEGUTIFL-UHFFFAOYSA-N
- 1915368
MolClass #15022
JPOAZIVOEAPFSK-UHFFFAOYSA-N
- 1918413
MolClass #15023
- 1972114
MolClass #15024
- 1050798
MolClass #15025
WYDBFRQNRYIZSL-UHFFFAOYSA-N
- 1364217
MolClass #15026
IFGXGQPWAMQGSM-UHFFFAOYSA-N
- 2070292
MolClass #15027
DZMZPSYKSBOBEN-UHFFFAOYSA-N
- 3024971
MolClass #15028
- 1967330
MolClass #15029
- 2063262
MolClass #15030
XYMPMULTGOHMOC-UHFFFAOYSA-N
- 128
MolClass #15031
- 3120234
MolClass #15032
- 1333477
MolClass #15033
AKPJIQNCUBOTQL-UHFFFAOYSA-N
- 1910354
MolClass #15034
ISYOXTQRQHVWBH-MTJSOVHGSA-N
- 1318943
MolClass #15035
JDHAGRZNFXBXKP-UHFFFAOYSA-N
- 3032481
MolClass #15036
ZCZOAZQPIZRACP-UHFFFAOYSA-N
- 1618000
MolClass #15037
RVXFERDBNJSQDX-UHFFFAOYSA-N
- 1564417
MolClass #15038
GFHHYUBACWZQPN-UHFFFAOYSA-N
- 1909334
MolClass #15039
ONVKCTCBRHFRAU-UHFFFAOYSA-N
- 1941740
MolClass #15040
MANVPBRYADWILI-SYZQJQIISA-N
- 1335785
MolClass #15041
RYXHOCTUUSOOOE-UHFFFAOYSA-N
- 1163362
MolClass #15042
- 1985005
MolClass #15043
KEIZMKJWGWMDSY-UHFFFAOYSA-N
- 1741860
MolClass #15044
WGSMDUOSIYVQBT-UHFFFAOYSA-N
- 1946895
MolClass #15045
WHHUKWZWXTXNJI-UHFFFAOYSA-N
- 3124302
MolClass #15046
ZBBVJAIRIZJBTL-UHFFFAOYSA-N
- 1782201
MolClass #15047
LDURSNDWPZXLBU-UHFFFAOYSA-N
- 1947782
MolClass #15048
- 1011211
MolClass #15049
RAJWOBJTTGJROA-UHFFFAOYSA-N
- 2070250
MolClass #15050
JTTDFZPQLVUNOQ-UHFFFAOYSA-N
- 1935532
MolClass #15051
ZKROGKDKZNBCDE-UHFFFAOYSA-N
- 1625308
MolClass #15052
ILSAONGGBDPOMC-UHFFFAOYSA-N
- 3011271
MolClass #15053
VNYMDHCWFVUIMF-DJWKRKHSSA-N
- 1941849
MolClass #15054
- 1982753
MolClass #15055
MTRVLXNXXKNLTB-UHFFFAOYSA-N
- 1951039
MolClass #15056
GNFQTVMRGNWZIY-UHFFFAOYSA-N
- 1775101
MolClass #15057
- 1310409
MolClass #15058
PYJIJURLQOREJT-UHFFFAOYSA-N
- 1987310
MolClass #15059
IXXKLXBLNQSSFP-UHFFFAOYSA-N
- 3054834
MolClass #15060
RMSWBHUVFNFNIZ-ZETCQYMHSA-N
- 1984743
MolClass #15061
- 1986030
MolClass #15062
RVENZTWIDBDKMP-UHFFFAOYSA-N
- 1912041
MolClass #15063
OTAINLTYVFTSOE-UHFFFAOYSA-N
- 1240243
MolClass #15064
DKQWRKBVUFBHJS-UHFFFAOYSA-N
- 2081025
MolClass #15065
PXOYOCNNSUAQNS-AGNJHWRGSA-N
- 1912109
MolClass #15066
BNLHHQMPFAULMZ-UHFFFAOYSA-N
- 3040932
MolClass #15067
PCWDHVNLAPVIJW-UHFFFAOYSA-N
- 1917816
MolClass #15068
- 1418249
MolClass #15069
- 3125027
MolClass #15070
- 1985880
MolClass #15071
YASNQFJBYHTGIZ-UHFFFAOYSA-N
- 1175313
MolClass #15072
YRECYLODAFFLEU-UHFFFAOYSA-N
- 1988100
MolClass #15073
LBMWERLPTSXWHA-UHFFFAOYSA-N
- 1686043
MolClass #15074
XZZPCZFKLXRDEE-UHFFFAOYSA-N
- 2069598
MolClass #15075
KITQDZFSOKQGAX-UHFFFAOYSA-N
- 1739369
MolClass #15076
AEKVVFMDSAVEKH-UHFFFAOYSA-N
- 1190390
MolClass #15077
KMFFLCUTWNYWOZ-UHFFFAOYSA-N
- 1988781
MolClass #15078
- 2061483
MolClass #15079
WGDYMCOUCSRPEO-WUXMJOGZSA-N
- 1455970
MolClass #15080
JDPNYMQTDQFIDH-UHFFFAOYSA-N
- 1434180
MolClass #15081
LTHQPAHRYJXSTK-UHFFFAOYSA-N
- 1983964
MolClass #15082
FSZBHBMWHIVTFF-UHFFFAOYSA-N
- 1312145
MolClass #15083
HMKDOXIHYYWELC-UHFFFAOYSA-N
- 3020556
MolClass #15084
YOEPXDGVNDPORP-FMIVXFBMSA-O
- 1947789
MolClass #15085
- 1974711
MolClass #15086
RRKRUAVPWCQJLT-UHFFFAOYSA-N
- 1943627
MolClass #15087
KNTCQDMJAZHEEF-UHFFFAOYSA-N
- 1982921
MolClass #15088
WUWFLGDJPVAKLR-UHFFFAOYSA-N
- 1266738
MolClass #15089
MPZRSZDKQMRTHX-UHFFFAOYSA-N
- 1339314
MolClass #15090
PLWCFMWYVHEBMD-UHFFFAOYSA-N
- 3043460
MolClass #15091
NWXDJIQFMKHGRA-UHFFFAOYSA-N
- 1438367
MolClass #15092
ZFVKJXIXLUKEKF-UHFFFAOYSA-N
- 1977984
MolClass #15093
- 1969941
MolClass #15094
PCYGGTVQMDGQFW-UHFFFAOYSA-N
- 1511846
MolClass #15095
KTRZFDUOUIVFLG-UHFFFAOYSA-N
- 1309580
MolClass #15096
YXQNIFCRMIMUPG-UHFFFAOYSA-N
- 1982171
MolClass #15097
- 1655776
MolClass #15098
- 1911791
MolClass #15099
WENMELRXJYNJOM-UHFFFAOYSA-O
- 1909147
MolClass #15100
DZJGTLTVRVGJIX-UHFFFAOYSA-N