Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 24786138
MolClass #41001
RKCILQMNCUQMNQ-UHFFFAOYSA-N
- 24837056
MolClass #41002
YGZXUVCNAKQYOA-UHFFFAOYSA-N
- 7969359
MolClass #41003
BCAYUKJWWBNGFF-UHFFFAOYSA-N
- 24834288
MolClass #41004
ANADVWZWVONQOM-UHFFFAOYSA-N
- 24828211
MolClass #41005
KPOJURCAAOIEHP-UHFFFAOYSA-N
- 14727997
MolClass #41006
KPYMUIGOLOGEBW-UHFFFAOYSA-N
- 17513979
MolClass #41007
QAVKCTBJJVXIIA-UHFFFAOYSA-N
- 14724467
MolClass #41008
XODVKFNJJDPTDS-UHFFFAOYSA-N
- 22402631
MolClass #41009
SQVCRPCYVJYJJI-UHFFFAOYSA-N
- 861800
MolClass #41010
GXCOQECPHALNOB-UHFFFAOYSA-N
- 17410030
MolClass #41011
RLVVYWRGYFRTKH-UHFFFAOYSA-N
- 7978006
MolClass #41012
AOLCPXRGICDDCR-UHFFFAOYSA-N
- 14746003
MolClass #41013
CJSBBECUJITPTA-UHFFFAOYSA-N
- 14728308
MolClass #41014
UFWOSOSCNQXBCY-VCHYOVAHSA-N
- 24784786
MolClass #41015
NHEZCOHEPWSEMW-VIZOYTHASA-N
- 24807396
MolClass #41016
PYOMMFZCTIFHMA-UHFFFAOYSA-N
- 14738556
MolClass #41017
CLTJREZNPVFWGQ-UHFFFAOYSA-N
- 24797011
MolClass #41018
FKJOTFPQZUSRBE-UHFFFAOYSA-N
- 7966188
MolClass #41019
OEAKWKMUPMLMDO-UHFFFAOYSA-N
- 3716561
MolClass #41020
- 14734528
MolClass #41021
BAKCYWKIVVXZNA-UHFFFAOYSA-N
- 14739247
MolClass #41022
KTXURXGAKPHLAH-UHFFFAOYSA-N
- 4259753
MolClass #41023
WNKMXLKJTWDUMZ-UHFFFAOYSA-N
- 24805801
MolClass #41024
- 856224
MolClass #41025
GBCQTBZAGQKBSG-UHFFFAOYSA-N
- 864258
MolClass #41026
LWVTZFJLQSYOSF-UHFFFAOYSA-N
- 22412375
MolClass #41027
DSLMXVUSWWZKJA-PXNMLYILSA-N
- 7972898
MolClass #41028
LZRLOWGNHYRGTI-UHFFFAOYSA-N
- 24825217
MolClass #41029
SOUVKDYFLYBBQY-UHFFFAOYSA-N
- 3712917
MolClass #41030
SFEJDPWUGVSQFT-UHFFFAOYSA-N
- 24809746
MolClass #41031
GXFUOCQAEIOYDU-UHFFFAOYSA-N
- 4263349
MolClass #41032
BKWOSDQVFGPKFT-UHFFFAOYSA-N
- 24780700
MolClass #41033
LBCLDLLFUHWGGK-UHFFFAOYSA-N
- 24779692
MolClass #41034
- 14733047
MolClass #41035
JIILDQFDAWMOHY-UHFFFAOYSA-N
- 24781344
MolClass #41036
KHVNTRNBEHYNMS-RQZCQDPDSA-N
- 17510179
MolClass #41037
ANMNUJNHTPGLGU-UHFFFAOYSA-N
- 24808869
MolClass #41038
LLFZGCFBAOVAAN-UHFFFAOYSA-N
- 17403353
MolClass #41039
OQWWABIXMUFBIU-UHFFFAOYSA-N
- 17411716
MolClass #41040
AHGDOINZUDZQTR-VLAVLTJUSA-N
- 14720670
MolClass #41041
LVQQTDJOVUGDGX-UHFFFAOYSA-N
- 3713720
MolClass #41042
PBGISIMZKZSNKZ-UHFFFAOYSA-N
- 4262217
MolClass #41043
PXYRYDJHIACVDI-UHFFFAOYSA-N
- 14732020
MolClass #41044
RIYAVBCWDKJNNO-UHFFFAOYSA-N
- 14732885
MolClass #41045
UPHZIKJOSJDQLD-UHFFFAOYSA-N
- 859394
MolClass #41046
RBKXGBLBQLYFOL-UHFFFAOYSA-N
- 14746461
MolClass #41047
AIMWEBWUEILSCH-UHFFFAOYSA-N
- 7969664
MolClass #41048
FFJDLOLHSBSSKN-UHFFFAOYSA-N
- 14728904
MolClass #41049
UFEUBMGMDIHOCU-UFYCRDLUSA-N
- 24796111
MolClass #41050
FNBZANSTWMJZTO-UHFFFAOYSA-N
- 4262594
MolClass #41051
- 22415078
MolClass #41052
PDQKXFPWLJRQCN-LZYBPNLTSA-N
- 861822
MolClass #41053
URGXVVUPNVVXMR-QGOAFFKASA-N
- 14730722
MolClass #41054
JBCYGVPTPDCNBG-UHFFFAOYSA-N
- 14720820
MolClass #41055
MDYNKRGMMNIGCM-UHFFFAOYSA-N
- 22403506
MolClass #41056
NZQOBMMVFVOVPQ-UHFFFAOYSA-N
- 4243773
MolClass #41057
PJIDWAVVHABSJB-UHFFFAOYSA-N
- 24818306
MolClass #41058
ZEOGBFBQBNNAMC-UHFFFAOYSA-N
- 4244762
MolClass #41059
RCUGICUPGGIZDM-UHFFFAOYSA-N
- 7967780
MolClass #41060
NCHZLTMLWIYKFH-UHFFFAOYSA-N
- 24803868
MolClass #41061
GVOGRRJHRFGSQP-UHFFFAOYSA-N
- 7965433
MolClass #41062
GPBSBDSLSDUSOK-UHFFFAOYSA-N
- 24810945
MolClass #41063
- 22400420
MolClass #41064
WLMHYGXRUWDIRC-UHFFFAOYSA-N
- 24809786
MolClass #41065
GNCJKJCWVWPRNH-XFFZJAGNSA-N
- 843903
MolClass #41066
VBEFKKAUPMBZSB-UHFFFAOYSA-N
- 24835529
MolClass #41067
LFWRNBBHBHBODY-UHFFFAOYSA-N
- 7974993
MolClass #41068
OLTVUSSSEQRDLG-UHFFFAOYSA-N
- 7970101
MolClass #41069
STUXGHBBVDQONL-UHFFFAOYSA-N
- 17402317
MolClass #41070
UFZCVNIUMATMLR-UHFFFAOYSA-N
- 7972693
MolClass #41071
VCFQUELPHGNCFO-UHFFFAOYSA-N
- 17508415
MolClass #41072
YFKDPARAEVCQCC-UHFFFAOYSA-N
- 17386393
MolClass #41073
KOVGYTKLOWTJTA-UHFFFAOYSA-N
- 4260028
MolClass #41074
HPKWIJKLVOSDEK-ACCUITESSA-N
- 14727396
MolClass #41075
XIXUZLFILBOXAI-UHFFFAOYSA-M
- 14737536
MolClass #41076
- 17409698
MolClass #41077
HNMXEGLZECPSJN-UHFFFAOYSA-N
- 24820385
MolClass #41078
GRNDEBXMZSNLCP-UHFFFAOYSA-N
- 17410110
MolClass #41079
DGXNPEWTHYPMMI-UHFFFAOYSA-N
- 4242701
MolClass #41080
QYFKEZSHWMEKFG-UHFFFAOYSA-N
- 17508354
MolClass #41081
FVISPXSECSDPKC-UHFFFAOYSA-N
- 17408760
MolClass #41082
VFDJOWRKMAQVTJ-UHFFFAOYSA-N
- 4264192
MolClass #41083
OORANODXPOOSAC-UHFFFAOYSA-N
- 859852
MolClass #41084
ANUCTJVANGVDSY-UHFFFAOYSA-N
- 857453
MolClass #41085
XZDJLQPOYUSHRN-UHFFFAOYSA-N
- 22408728
MolClass #41086
BUSRWZQVWVRPKT-ZROIWOOFSA-N
- 14723834
MolClass #41087
WQRGFXWTNZARPJ-UHFFFAOYSA-N
- 3714712
MolClass #41088
NJDFKVDRCDBLAV-UHFFFAOYSA-N
- 24782977
MolClass #41089
- 24796558
MolClass #41090
XWOHQUKPOZORRI-UHFFFAOYSA-N
- 24810932
MolClass #41091
UNAHYOFZPLPNBB-UHFFFAOYSA-N
- 24809428
MolClass #41092
DTKUADYOSMPHLP-UHFFFAOYSA-N
- 14738533
MolClass #41093
PGDADGOXBKQUHK-UHFFFAOYSA-N
- 22414959
MolClass #41094
HTETVHFZSGIYQT-UHFFFAOYSA-N
- 3715050
MolClass #41095
FLHOTAOCVSITAB-UHFFFAOYSA-N
- 7968688
MolClass #41096
LQCAYZNOICPVFL-UHFFFAOYSA-N
- 4247631
MolClass #41097
DSHUVWRTVUJSDC-UHFFFAOYSA-N
- 24799811
MolClass #41098
ZEMAHOYXOAHHGN-UHFFFAOYSA-N
- 4255716
MolClass #41099
ACAPZJMSBGNNHG-UHFFFAOYSA-N
- 4256052
MolClass #41100
MMJZKJFVZSJXPP-UHFFFAOYSA-N