Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 736715
MolClass #9601
- 716312
MolClass #9602
XWHHYOYVRVGJJY-QMMMGPOBSA-N
- 688272
MolClass #9603
BGRJTUBHPOOWDU-NSHDSACASA-N
- 688095
MolClass #9604
- 657346
MolClass #9605
COSSAOQSSXDIQW-JGVFFNPUSA-N
- 656717
MolClass #9606
RNOJGTHBMJBOSP-KRWDZBQOSA-N
- 451515
MolClass #9607
HBOMLICNUCNMMY-BWZBUEFSSA-N
- 447916
MolClass #9608
OIRDTQYFTABQOQ-GAWUUDPSSA-N
- 447196
MolClass #9609
AXXYLTBQIQBTES-BYPYZUCNSA-N
- 446849
MolClass #9610
MASYAWHPJCQLSW-ZIAGYGMSSA-N
- 445629
MolClass #9611
HGCGJTZCWZFGBT-XUIVZRPNSA-N
- 445227
MolClass #9612
UFSBFVZQJZMIOU-LZQZFOIKSA-N
- 443600
MolClass #9613
XJLATMLVMSFZBN-VYDXJSESSA-N
- 443586
MolClass #9614
HOOWCUZPEFNHDT-ZETCQYMHSA-N
- 443239
MolClass #9615
YYLQUHNPNCGKJQ-LWMBPPNESA-N
- 443120
MolClass #9616
POHHFIIXXRDDJW-STQMWFEESA-N
- 441350
MolClass #9617
NHTGHBARYWONDQ-JTQLQIEISA-N
- 440707
MolClass #9618
WHBHBVVOGNECLV-OBQKJFGGSA-N
- 440005
MolClass #9619
MRAUNPAHJZDYCK-BYPYZUCNSA-N
- 439744
MolClass #9620
UQTZMGFTRHFAAM-ZETCQYMHSA-N
- 439647
MolClass #9621
MQUQNUAYKLCRME-INIZCTEOSA-N
- 439280
MolClass #9622
- 433294
MolClass #9623
VEXZGXHMUGYJMC-UHFFFAOYSA-M
- 260390
MolClass #9624
- 202477
MolClass #9625
HTSNFXAICLXZMA-ZDUSSCGKSA-N
- 197067
MolClass #9626
- 196663
MolClass #9627
IUXBQXVKCIOQKX-RYUDHWBXSA-N
- 194216
MolClass #9628
ZAIPMKNFIOOWCQ-HUFXEGEASA-N
- 184822
MolClass #9629
JWHAUXFOSRPERK-SFHVURJKSA-N
- 172306
MolClass #9630
WDTAYDBPNYFWDR-WOJBJXKFSA-N
- 169373
MolClass #9631
RDLPVSKMFDYCOR-HUFXEGEASA-N
- 167529
MolClass #9632
WNNNWFKQCKFSDK-BYPYZUCNSA-N
- 164437
MolClass #9633
FDEACFAXFCKCHZ-MOROJQBDSA-N
- 160453
MolClass #9634
FEFFSKLJNYRHQN-VIFPVBQESA-N
- 160436
MolClass #9635
- 160355
MolClass #9636
BTIHMVBBUGXLCJ-OAHLLOKOSA-N
- 157991
MolClass #9637
ZIIQCSMRQKCOCT-RXMQYKEDSA-N
- 155806
MolClass #9638
- 145685
MolClass #9639
- 135313
MolClass #9640
RHVVRMJOHATSPD-VKHMYHEASA-N
- 134645
MolClass #9641
UREBDLICKHMUKA-PLZGPXMBSA-N
- 133633
MolClass #9642
- 133012
MolClass #9643
- 132837
MolClass #9644
- 132787
MolClass #9645
QJPPEMXOOWNICQ-UHFFFAOYSA-N
- 132496
MolClass #9646
- 124887
MolClass #9647
IDEHCMNLNCJQST-UHFFFAOYSA-N
- 122926
MolClass #9648
- 122634
MolClass #9649
PHEDXBVPIONUQT-LQLWEASQSA-N
- 119565
MolClass #9650
KJQFBVYMGADDTQ-CVSPRKDYSA-N
- 115227
MolClass #9651
JPAWFIIYTJQOKW-UHFFFAOYSA-N
- 107704
MolClass #9652
- 104999
MolClass #9653
- 104895
MolClass #9654
YNZFFALZMRAPHQ-SYYKKAFVSA-N
- 104766
MolClass #9655
YFYNOWXBIBKGHB-FBCQKBJTSA-N
- 104762
MolClass #9656
HZQDCMWJEBCWBR-UUOKFMHZSA-N
- 99625
MolClass #9657
OYHLRJGDELITAF-INIZCTEOSA-N
- 92913
MolClass #9658
MEZLKOACVSPNER-UHFFFAOYSA-N
- 92222
MolClass #9659
WTDRDQBEARUVNC-ZCFIWIBFSA-N
- 92136
MolClass #9660
OYIFNHCXNCRBQI-BYPYZUCNSA-N
- 73093
MolClass #9661
RDFCSSHDJSZMTQ-ZDUSSCGKSA-N
- 72430
MolClass #9662
NGBKFLTYGSREKK-PMACEKPBSA-N
- 71754
MolClass #9663
VHSBBVZJABQOSG-MRXNPFEDSA-N
- 71587
MolClass #9664
YNZFUWZUGRBMHL-UHFFFAOYSA-N
- 71398
MolClass #9665
HCZKYJDFEPMADG-TXEJJXNPSA-N
- 71077
MolClass #9666
MTCFGRXMJLQNBG-UWTATZPHSA-N
- 70547
MolClass #9667
- 68841
MolClass #9668
BZQFBWGGLXLEPQ-REOHCLBHSA-N
- 68368
MolClass #9669
MRWXACSTFXYYMV-FDDDBJFASA-N
- 67652
MolClass #9670
- 11957649
MolClass #9671
- 66091
MolClass #9672
- 9601084
MolClass #9673
AKXCFAYOTIEFOH-XTNAHFASSA-N
- 4605800
MolClass #9674
- 24867517
MolClass #9675
KPJZHOPZRAFDTN-YZVOILCLSA-N
- 65752
MolClass #9676
- 65253
MolClass #9677
VPVOXUSPXFPWBN-VKHMYHEASA-N
- 64392
MolClass #9678
GKCGWXNLOYTUNC-UHFFFAOYSA-N
- 60703
MolClass #9679
GGUSQTSTQSHJAH-UHFFFAOYSA-N
- 47812
MolClass #9680
- 42890
MolClass #9681
XDXDZDZNSLXDNA-TZNDIEGXSA-N
- 40958
MolClass #9682
QYIYFLOTGYLRGG-WUMONGPASA-N
- 40539
MolClass #9683
ASNFTDCKZKHJSW-REOHCLBHSA-N
- 27944
MolClass #9684
HLFSDGLLUJUHTE-SNVBAGLBSA-N
- 6437377
MolClass #9685
JQYLIGHHVGCTPR-LYRPIDSHSA-N
- 22880
MolClass #9686
HOKKHZGPKSLGJE-GSVOUGTGSA-N
- 18343
MolClass #9687
ZWAOHEXOSAUJHY-ZIYNGMLESA-N
- 18283
MolClass #9688
XNKLLVCARDGLGL-JGVFFNPUSA-N
- 16817
MolClass #9689
UQOFGTXDASPNLL-XHNCKOQMSA-N
- 16486
MolClass #9690
IADUEWIQBXOCDZ-VKHMYHEASA-N
- 10255
MolClass #9691
VLSMHEGGTFMBBZ-OOZYFLPDSA-N
- 9433
MolClass #9692
- 8515
MolClass #9693
- 6758
MolClass #9694
JUVIOZPCNVVQFO-HBGVWJBISA-N
- 6322
MolClass #9695
ODKSFYDXXFIFQN-BYPYZUCNSA-N
- 6305
MolClass #9696
- 6198
MolClass #9697
- 6169
MolClass #9698
- 6128
MolClass #9699
AEMFNILZOJDQLW-QAGGRKNESA-N
- 6112
MolClass #9700
AGBQKNBQESQNJD-SSDOTTSWSA-N