Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 2080281
MolClass #11601
DKIXYFHAZQQVHO-UHFFFAOYSA-N
- 1012223
MolClass #11602
SAMCUNVIALDNBU-UHFFFAOYSA-N
- 1012581
MolClass #11603
LKEMVVCLTDWQJE-UHFFFAOYSA-N
- 1003335
MolClass #11604
KQTIIICEAUMSDG-UHFFFAOYSA-N
- 1036434
MolClass #11605
MOWWNCUQNURBRK-UHFFFAOYSA-N
- 1094883
MolClass #11606
- 1098994
MolClass #11607
TYDGDUVFDYKZMY-UHFFFAOYSA-N
- 1004016
MolClass #11608
HBRVUQIGDLSBCB-UHFFFAOYSA-N
- 2081011
MolClass #11609
BRPCUNWSXFDLON-UHFFFAOYSA-N
- 2081404
MolClass #11610
DRLPKIYKZSQYRJ-UHFFFAOYSA-O
- 1028999
MolClass #11611
ZJINUQHUNJMQFN-UHFFFAOYSA-N
- 2121691
MolClass #11612
PBUFFVDXVPSIOA-UXBLZVDNSA-N
- 1011216
MolClass #11613
WIJJWWIBCIACQL-UHFFFAOYSA-N
- 2121606
MolClass #11614
GQYYIMWMAHTMMR-SNAWJCMRSA-N
- 1023644
MolClass #11615
PTFKKKOYWVQBCY-UHFFFAOYSA-N
- 2121608
MolClass #11616
HOWNYMIEBNTOBI-DHZHZOJOSA-N
- 2121610
MolClass #11617
DSLBDPPHINVUID-REOHCLBHSA-N
- 2121611
MolClass #11618
ICCJHMNYUMDWSP-FBCQKBJTSA-N
- 2121612
MolClass #11619
CUDFQKSZEIHDPO-WSKFYRRCSA-N
- 1039200
MolClass #11620
- 2121613
MolClass #11621
KOIWZZHRJVZYBT-ZCFIWIBFSA-N
- 1026338
MolClass #11622
HCFWGTJOPSZOLK-UHFFFAOYSA-N
- 2121614
MolClass #11623
USRGIUJOYOXOQJ-HRFVKAFMSA-N
- 2121615
MolClass #11624
OUQYPJOGYALLBV-YFKPBYRVSA-N
- 2121617
MolClass #11625
IWXJOGVQEPOQSU-LOKZPNRRSA-N
- 2121624
MolClass #11626
UXTSQCOOUJTIAC-QGZVFWFLSA-N
- 2121626
MolClass #11627
FAYFFRUYRMMPAX-UHFFFAOYSA-N
- 1009297
MolClass #11628
HGVQBXSOAUVVNX-UHFFFAOYSA-N
- 2121627
MolClass #11629
PAZLDCLXTQATBO-JOCHJYFZSA-N
- 2121628
MolClass #11630
WDEAKMXEZRUYOK-MRXNPFEDSA-N
- 2121632
MolClass #11631
GQRGREOAXWDDQQ-JJYYJPOSSA-N
- 1047542
MolClass #11632
JIKHJTHQLORZIX-UHFFFAOYSA-N
- 2121633
MolClass #11633
KRKRAOXTGDJWNI-IMJSIDKUSA-N
- 2121640
MolClass #11634
LFFQVHXIFJLJSP-WUFINQPMSA-N
- 2121646
MolClass #11635
- 2121649
MolClass #11636
FEQOAJFIPPBRLL-ZCFIWIBFSA-N
- 2121663
MolClass #11637
BLLIIPIJZPKUEG-KBBAHBAISA-N
- 2121666
MolClass #11638
MIKUYHXYGGJMLM-ICKFSKTQSA-N
- 2121681
MolClass #11639
TWOWSRSKGJSZHZ-LWVOUPCSSA-N
- 1009856
MolClass #11640
JFXXHIZGJDHSSF-UHFFFAOYSA-N
- 2121690
MolClass #11641
- 2121692
MolClass #11642
TVLCSRRBARSVKF-VKHMYHEASA-N
- 2121694
MolClass #11643
MBXNBYCQXFRCLX-BJZNPKPOSA-N
- 3186842
MolClass #11644
HVGNSPLLPQWYGC-UHFFFAOYSA-N
- 2121722
MolClass #11645
OPQNCARIZFLNLF-BXZRDGIFSA-N
- 1010014
MolClass #11646
- 2121729
MolClass #11647
XFWXEJQQQBAMOL-JCSXPCGZSA-N
- 2121738
MolClass #11648
UZWXFNTWGDDBQM-QMMMGPOBSA-N
- 2121744
MolClass #11649
- 2121745
MolClass #11650
SHZGCJCMOBCMKK-QYESYBIKSA-N
- 2121747
MolClass #11651
XAWIYXBFKANEFM-LLVKDONJSA-N
- 1044291
MolClass #11652
VOOQJHYXJMACQI-UHFFFAOYSA-N
- 2121748
MolClass #11653
QKHQITUHYKZKJI-MRVPVSSYSA-N
- 2121749
MolClass #11654
XSQKKPFNIVGDHL-JAFRLTCSSA-N
- 2121758
MolClass #11655
- 2121761
MolClass #11656
VTKTXPZDLMLASC-UHFFFAOYSA-L
- 2020823
MolClass #11657
XCYGDDBCVDPMJL-KNQAVFIVSA-N
- 2023472
MolClass #11658
GOAGYJLUVHHOHG-HSXBEVGYSA-N
- 2021323
MolClass #11659
FGCXZXVUKUTVJF-MFIBOOTFSA-N
- 2022441
MolClass #11660
IKHNFNXXGDAMPZ-BZNBAONSSA-N
- 2020556
MolClass #11661
JQHSMSRHGNPDRJ-QFIVOURISA-N
- 2021849
MolClass #11662
QWDLVNOGSCWDCK-SGQNLQFHSA-N
- 2023534
MolClass #11663
AWTKZLHOGGAARM-ISTJGCCRSA-N
- 2021587
MolClass #11664
MNSBHICZZULRJA-BQUQFXLMSA-N
- 2021650
MolClass #11665
HBAJWISPDVVMHE-BQUQFXLMSA-N
- 2019424
MolClass #11666
QIHNPQWVNPRKJL-RXFWQSSRSA-N
- 2021609
MolClass #11667
ZBFYKSVVVJEOAR-LMSVJFOSSA-N
- 2020821
MolClass #11668
HWUJPXBNYQKXRJ-RDGATRHJSA-N
- 2022414
MolClass #11669
MSENISSCKSXWTK-ROZHPIASSA-N
- 2019761
MolClass #11670
GANHRKFKUXTRAF-WIOPSUGQSA-N
- 2022995
MolClass #11671
KMXTWBDSWVGWRY-JLELKNTQSA-N
- 2022933
MolClass #11672
- 2023161
MolClass #11673
ADWDTXIOJXSOGW-DNYCYBFCSA-N
- 2023344
MolClass #11674
- 2020011
MolClass #11675
RRUUXDJXBNSWCM-LITSAYRRSA-N
- 2020585
MolClass #11676
DBBJXKUKXHQUEX-APWZRJJASA-N
- 2021604
MolClass #11677
WAMDVKVZRPPZFC-ZOIIRCJOSA-N
- 2023350
MolClass #11678
PLFUDYDZZRSEMB-LDBJRWBKSA-N
- 2020690
MolClass #11679
MUSUWZRVBFCLAH-RLWLMLJZSA-N
- 2022567
MolClass #11680
XFUPDRLLBIDKGG-JMUYFFGJSA-N
- 2021935
MolClass #11681
MXHJOUHOTHDBGI-CBGDNZLLSA-N
- 2022687
MolClass #11682
WFNGRUMMVOHUNL-FCDUAZGNSA-N
- 2021068
MolClass #11683
ANONUDOVUWXMDK-NJHZRGNWSA-N
- 2019612
MolClass #11684
- 2020797
MolClass #11685
AUCJRSIBEHMTCF-KOSHJBKYSA-N
- 2019635
MolClass #11686
PTFKRZGMZGKCJS-DOTOQJQBSA-N
- 3089766
MolClass #11687
INADHJKKGXCSHN-YOGXEWEVSA-N
- 3213940
MolClass #11688
AXTMCPCFQLRGDB-LYBHJNIJSA-N
- 3213942
MolClass #11689
VDVHORVFGFIJQZ-PTGBLXJZSA-N
- 3214234
MolClass #11690
LPFGJNBBTXCVJB-HZHRSRAPSA-N
- 3214218
MolClass #11691
BMZMMMJPXHKWEW-JJIBRWJFSA-N
- 3214256
MolClass #11692
YDNAPPSWNFTCFY-PCLIKHOPSA-N
- 3214230
MolClass #11693
JNXDFUBLWGDLQS-HZHRSRAPSA-N
- 3213692
MolClass #11694
GNKUEBUEJXLWNR-RCCKNPSSSA-N
- 3214288
MolClass #11695
ODKMCEFYRJWKHQ-KGENOOAVSA-N
- 3214238
MolClass #11696
LPEIWHLOCJFLRY-ZXVVBBHZSA-N
- 3213672
MolClass #11697
LKDTZIWYWSKIKP-QGOAFFKASA-N
- 3213688
MolClass #11698
SVWNHCFSWHLULR-GZTJUZNOSA-N
- 3214374
MolClass #11699
WGGXFSAXKLJKCF-GYZOOYGHSA-N
- 3214226
MolClass #11700
DSXZBFNSYOQFQG-RCCKNPSSSA-N