Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 7966063
MolClass #27601
ZBKRLQLGOYDKLA-UHFFFAOYSA-N
- 14730671
MolClass #27602
UBPUFJUMTJUBND-UHFFFAOYSA-N
- 24805433
MolClass #27603
URBJLDIMYRVKRB-UHFFFAOYSA-N
- 17402952
MolClass #27604
GTBQDNPKLQYVCQ-UHFFFAOYSA-N
- 852091
MolClass #27605
PMPNTJQPLDGDLF-UHFFFAOYSA-N
- 17402747
MolClass #27606
VIJKPGLSWADBGL-UHFFFAOYSA-N
- 49646188
MolClass #27607
JNZBTPZSMODXSL-UHFFFAOYSA-N
- 846430
MolClass #27608
QDBBFORVWWODCU-UHFFFAOYSA-N
- 858558
MolClass #27609
ZZYNENCKNHQTFR-UHFFFAOYSA-N
- 49681602
MolClass #27610
HDOVUKNUBWVHOX-QMMMGPOBSA-N
- 851205
MolClass #27611
JXCBAZUXWWKMNG-XFXZXTDPSA-N
- 3711307
MolClass #27612
NYSJNJJHDCQQON-UHFFFAOYSA-N
- 26725078
MolClass #27613
SRUILBLGVMJFPG-YDROHTJRSA-N
- 22409800
MolClass #27614
IRYCSUZJXRBQHE-UHFFFAOYSA-O
- 4245993
MolClass #27615
IZSCIPWVUBIODT-UHFFFAOYSA-N
- 24806658
MolClass #27616
MUOXIYDJUNICBE-UHFFFAOYSA-N
- 47204716
MolClass #27617
ICLVDQPERCVAHV-UHFFFAOYSA-N
- 26657927
MolClass #27618
ILQLITDRYFHAGM-UHFFFAOYSA-N
- 7970117
MolClass #27619
OHQFJIAXJIXJMJ-UHFFFAOYSA-N
- 26730778
MolClass #27620
VQXFJGUXMPRXOH-UHFFFAOYSA-N
- 14742887
MolClass #27621
ODUCQWKUGWHZHE-UHFFFAOYSA-N
- 860346
MolClass #27622
IHHJHOMBZIWVOJ-UHFFFAOYSA-N
- 864873
MolClass #27623
YXAYOHWXSOADHL-UHFFFAOYSA-N
- 14743026
MolClass #27624
HAJGRIJELRSGMX-UHFFFAOYSA-N
- 848666
MolClass #27625
OFGZQSNMGHRZQT-UHFFFAOYSA-N
- 22404752
MolClass #27626
QTVFSZVITMEZBT-UHFFFAOYSA-N
- 24708227
MolClass #27627
OPRFOVGATCTVOC-IUCAKERBSA-N
- 14741916
MolClass #27628
SELHUGVIDVJWPG-UHFFFAOYSA-N
- 3713173
MolClass #27629
KJROHAMFDJJMQK-UHFFFAOYSA-N
- 4250181
MolClass #27630
CDZTXDKEMUFKOE-UHFFFAOYSA-N
- 26661681
MolClass #27631
NWGIJBRDVFIBHQ-UHFFFAOYSA-N
- 47203300
MolClass #27632
FXDUTFNPINZAKX-UHFFFAOYSA-N
- 74374036
MolClass #27633
QFVOYBUQQBFCRH-HFQBERHNSA-N
- 49826105
MolClass #27634
HCIKQUQYECOARC-UHFFFAOYSA-N
- 56319854
MolClass #27635
UHIBRLTUWKCTGR-VLGSPTGOSA-N
- 17509370
MolClass #27636
ABWCPNTWIPBERY-UHFFFAOYSA-N
- 24781895
MolClass #27637
OJPXXNBBEROJGM-UHFFFAOYSA-N
- 850390
MolClass #27638
JIYQEGVUIRJANB-UHFFFAOYSA-N
- 17409598
MolClass #27639
UUGYSJYNNDNYTN-UHFFFAOYSA-N
- 17386243
MolClass #27640
QEYYRLFQAWSBIA-UHFFFAOYSA-N
- 24783111
MolClass #27641
MVEIQAYTEARGHX-UHFFFAOYSA-N
- 24818484
MolClass #27642
- 24789750
MolClass #27643
QPCNORQBQSXLQL-UHFFFAOYSA-N
- 49674224
MolClass #27644
PYHSOYNJMMGIHW-UHFFFAOYSA-N
- 49647912
MolClass #27645
VEEFPMBCCJYPKM-INIZCTEOSA-N
- 24792001
MolClass #27646
MOGRDGVZYDEPBZ-UHFFFAOYSA-N
- 47199303
MolClass #27647
HYSASFYDLUOAEZ-UHFFFAOYSA-N
- 17508114
MolClass #27648
INCVOMVGYBBLFG-UHFFFAOYSA-N
- 47204304
MolClass #27649
XPSHOQZAOPEZGZ-UHFFFAOYSA-N
- 24813653
MolClass #27650
- 857846
MolClass #27651
JELKXMQISFGPPJ-OAHLLOKOSA-N
- 26663135
MolClass #27652
ZBDVYHHUPUPFQJ-UHFFFAOYSA-N
- 856132
MolClass #27653
NWYYWJWDBAJZCN-UHFFFAOYSA-N
- 24808610
MolClass #27654
IHSYIVAZIINDFR-UHFFFAOYSA-N
- 49665849
MolClass #27655
UDKDZFOQBNMDIS-UHFFFAOYSA-N
- 85146069
MolClass #27656
VKJPUPMRCWBZLR-JYRVWZFOSA-N
- 7978303
MolClass #27657
WCKQQLMOCYKKAO-UHFFFAOYSA-N
- 24838242
MolClass #27658
MHUPRUNDECHWLR-UHFFFAOYSA-N
- 24825064
MolClass #27659
WFJPRCMYUOOTNS-UHFFFAOYSA-N
- 81066549
MolClass #27660
OYOXEIQSBJFVIA-ANYFNZRUSA-N
- 4240717
MolClass #27661
NARWLYGPRBKBBA-UHFFFAOYSA-N
- 17431683
MolClass #27662
- 22414477
MolClass #27663
QURVTODAYUIBOK-OQLLNIDSSA-N
- 853264
MolClass #27664
MHSYGIYISFNELB-UHFFFAOYSA-N
- 14727492
MolClass #27665
DVJLWRRGZDRSCE-CIAFOILYSA-N
- 4263362
MolClass #27666
- 14725291
MolClass #27667
YBYAJDXREBXVDK-UHFFFAOYSA-N
- 24828856
MolClass #27668
MQGJLLGDRSSQQU-NTCAYCPXSA-N
- 49672224
MolClass #27669
AOKXKECEFQAIAD-UHFFFAOYSA-N
- 47193431
MolClass #27670
QKXYRRZHXYTYGA-UHFFFAOYSA-N
- 14728615
MolClass #27671
JLMGXXOJWVMRFD-JZRQUBEPSA-N
- 4258489
MolClass #27672
CXWWUJNVIVTUIE-UHFFFAOYSA-N
- 26665016
MolClass #27673
GOSOFAONCKLXHN-UKTHLTGXSA-N
- 858305
MolClass #27674
RIMSZFLGKGNZGP-IVYHHUKSSA-N
- 49729236
MolClass #27675
ZBKAJRKKNRDQIK-ONEGZZNKSA-N
- 26658280
MolClass #27676
FQIXXZAIZRXDCM-UHFFFAOYSA-N
- 22405186
MolClass #27677
DWVOZJJPKRMKDG-OVCLIPMQSA-N
- 85198200
MolClass #27678
GUTOGDLQHGZYDI-FCDQGJHFSA-N
- 14728619
MolClass #27679
MSDMSQHOLOYMKR-RWMGWMAGSA-N
- 26729010
MolClass #27680
XSMATDCSCZNOFK-PCAMWSOBSA-N
- 857983
MolClass #27681
HTLQIPSFRWPCRL-UHFFFAOYSA-N
- 46501253
MolClass #27682
SWJLTKXURNHVHE-SGAXEVNMSA-N
- 24819840
MolClass #27683
YKPNFHOHVDXVLE-UHFFFAOYSA-N
- 4245517
MolClass #27684
XRSBEBNTTLQZSP-UHFFFAOYSA-N
- 844131
MolClass #27685
STIWFCMLOIYCPT-UHFFFAOYSA-N
- 14742078
MolClass #27686
AOWIURVETPHHGI-UHFFFAOYSA-N
- 26657844
MolClass #27687
- 26664785
MolClass #27688
GDPLLJMLTUBHPH-UHFFFAOYSA-N
- 24791885
MolClass #27689
HQUNYAITJDMFAT-UHFFFAOYSA-N
- 856665
MolClass #27690
WJXIZLBMJFLASA-YIOZNXECSA-N
- 7965978
MolClass #27691
RYBWDGAALCAZQR-UHFFFAOYSA-N
- 24822675
MolClass #27692
WFHGRBSRETVBRA-UHFFFAOYSA-N
- 26659891
MolClass #27693
XXQURODNNRBKEW-UHFFFAOYSA-O
- 24828068
MolClass #27694
JLNIMPBBKZNOJG-UHFFFAOYSA-N
- 4265372
MolClass #27695
BZKMZALNEDJMLC-UHFFFAOYSA-N
- 46501271
MolClass #27696
XUHJBXVYNBQQBD-SHANDMFISA-N
- 4241141
MolClass #27697
VBUGVMDKXTYWKA-UHFFFAOYSA-N
- 4252379
MolClass #27698
- 47195318
MolClass #27699
- 14746620
MolClass #27700