Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- NOCAS_M370
MolClass #3601
NGFPWHGISWUQOI-UHFFFAOYSA-N
- 2461-43-0
MolClass #3602
WFRNIUYOWYOGTG-UHFFFAOYSA-N
- 53043-28-0
MolClass #3603
QVMUHZHZYCDMAI-UHFFFAOYSA-N
- 3022-61-5
MolClass #3604
JLVFGQSHNYEUIN-UHFFFAOYSA-N
- 1746-01-6
MolClass #3605
HGUFODBRKLSHSI-UHFFFAOYSA-N
- 92134-97-9
MolClass #3606
IFTUCGDOVRTECW-UHFFFAOYSA-N
- 110-61-2
MolClass #3607
IAHFWCOBPZCAEA-UHFFFAOYSA-N
- 18523-48-3
MolClass #3608
PPXUUPXQWDQNGO-UHFFFAOYSA-N
- 406-90-6
MolClass #3609
DLEGDLSLRSOURQ-UHFFFAOYSA-N
- NOCAS_M361
MolClass #3610
QEGKXSHUKXMDRW-UHFFFAOYSA-N
- 109-09-1
MolClass #3611
OKDGRDCXVWSXDC-UHFFFAOYSA-N
- 475-54-7
MolClass #3612
IXPNKNQCMVKKQH-UHFFFAOYSA-N
- 2872-48-2
MolClass #3613
TUXJTJITXCHUEL-UHFFFAOYSA-N
- NOCAS_M105
MolClass #3614
VGURJTTWZISZJM-UHFFFAOYSA-N
- 105360-93-8
MolClass #3615
DGIZFXFFGGKNIO-UHFFFAOYSA-N
- 963-89-3
MolClass #3616
HEFJMRLDXHSXEP-UHFFFAOYSA-N
- 7627-38-5
MolClass #3617
VLOODHWTRPYFIS-UHFFFAOYSA-N
- 116-85-8
MolClass #3618
AQXYVFBSOOBBQV-UHFFFAOYSA-N
- 92-52-4
MolClass #3619
ZUOUZKKEUPVFJK-UHFFFAOYSA-N
- 105453-67-6
MolClass #3620
RDJMBJBJQWPDEA-UHFFFAOYSA-N
- 517-82-8
MolClass #3621
NCFUWNUATANZPH-UHFFFAOYSA-N
- 110-85-0
MolClass #3622
GLUUGHFHXGJENI-UHFFFAOYSA-N
- 138580-44-6
MolClass #3623
- 33100-27-5
MolClass #3624
VFTFKUDGYRBSAL-UHFFFAOYSA-N
- 78-34-2
MolClass #3625
VBKKVDGJXVOLNE-UHFFFAOYSA-N
- 106-24-1
MolClass #3626
GLZPCOQZEFWAFX-UHFFFAOYSA-N
- 7083-63-8
MolClass #3627
NNHRVRJFHLVIIV-UHFFFAOYSA-N
- 39932-99-5
MolClass #3628
RVLMBTDFEBZGMJ-UHFFFAOYSA-N
- 4465-94-5
MolClass #3629
FYMCFKPEIMXMOB-UHFFFAOYSA-N
- 115-20-8
MolClass #3630
KPWDGTGXUYRARH-UHFFFAOYSA-N
- 149862-55-5
MolClass #3631
PUWMCBQWFRMGFG-UHFFFAOYSA-N
- 103-70-8
MolClass #3632
DYDNPESBYVVLBO-UHFFFAOYSA-N
- 29743-15-5
MolClass #3633
AUVREZVTBBIYLI-UHFFFAOYSA-N
- 766-40-5
MolClass #3634
ZAKLKBFCSHJIRI-UHFFFAOYSA-N
- 396-30-5
MolClass #3635
RMDCSDVIVXJELQ-UHFFFAOYSA-N
- 52101-36-7
MolClass #3636
UGNQSWFJOLHGLP-UHFFFAOYSA-N
- 83996-50-3
MolClass #3637
XPGDODOEEWLHOI-UHFFFAOYSA-N
- 23102-68-3
MolClass #3638
RIFXIBQABYTNNQ-UHFFFAOYSA-N
- 62895-88-9
MolClass #3639
RFPCZCUWSKCJNM-UHFFFAOYSA-N
- 113163-21-6
MolClass #3640
XUCKKNOAENHDDZ-UHFFFAOYSA-N
- 25082-33-1
MolClass #3641
ATALFKCHFKJEIN-UHFFFAOYSA-N
- 1143-38-0
MolClass #3642
NUZWLKWWNNJHPT-UHFFFAOYSA-N
- 479-27-6
MolClass #3643
YFOOEYJGMMJJLS-UHFFFAOYSA-N
- 100-53-8
MolClass #3644
UENWRTRMUIOCKN-UHFFFAOYSA-N
- 42522-72-5
MolClass #3645
AZSUKAMNDDZPEE-UHFFFAOYSA-N
- 103-89-9
MolClass #3646
YICAMJWHIUMFDI-UHFFFAOYSA-N
- 122365-34-8
MolClass #3647
JXSMDTQDKIEIHN-UHFFFAOYSA-N
- 69304-47-8
MolClass #3648
ODZBBRURCPAEIQ-UHFFFAOYSA-N
- 220168-52-5
MolClass #3649
RUXLDXUQVZKWOC-UHFFFAOYSA-N
- 118353-05-2
MolClass #3650
XSSYCIGJYCVRRK-UHFFFAOYSA-N
- 55481-88-4
MolClass #3651
VLGATXOTCNBWIT-UHFFFAOYSA-N
- 1663-39-4
MolClass #3652
ISXSCDLOGDJUNJ-UHFFFAOYSA-N
- 4368-56-3
MolClass #3653
GMBNNHLANOGOAU-UHFFFAOYSA-N
- 10318-26-0
MolClass #3654
VFKZTMPDYBFSTM-UHFFFAOYSA-N
- 161697-01-4
MolClass #3655
CAEPTVNEXFUBRY-UHFFFAOYSA-N
- 60110-37-4
MolClass #3656
GBWYPSSDQOXOFH-UHFFFAOYSA-N
- 868-85-9
MolClass #3657
HZCDANOFLILNSA-UHFFFAOYSA-N
- 28553-12-0
MolClass #3658
HBGGXOJOCNVPFY-UHFFFAOYSA-N
- 98033-23-9
MolClass #3659
CEMIXDMCYATVCD-UHFFFAOYSA-N
- 91-44-1
MolClass #3660
AFYCEAFSNDLKSX-UHFFFAOYSA-N
- 602-64-2
MolClass #3661
AHKDJQYHVWSRLT-UHFFFAOYSA-N
- 591-35-5
MolClass #3662
VPOMSPZBQMDLTM-UHFFFAOYSA-N
- 24463-19-2
MolClass #3663
PCVRSXXPGXRVEZ-UHFFFAOYSA-N
- 103630-35-9
MolClass #3664
DBPPEQIYWCILTJ-UHFFFAOYSA-N
- 109-65-9
MolClass #3665
MPPPKRYCTPRNTB-UHFFFAOYSA-N
- 95-93-2
MolClass #3666
SQNZJJAZBFDUTD-UHFFFAOYSA-N
- NOCAS_M248
MolClass #3667
QTEMKDHKICPASJ-UHFFFAOYSA-N
- 119-41-5
MolClass #3668
ZVXBAHLOGZCFTP-UHFFFAOYSA-N
- 110-02-1
MolClass #3669
YTPLMLYBLZKORZ-UHFFFAOYSA-N
- 420-46-2
MolClass #3670
UJPMYEOUBPIPHQ-UHFFFAOYSA-N
- 105-95-3
MolClass #3671
XRHCAGNSDHCHFJ-UHFFFAOYSA-N
- 64-18-6
MolClass #3672
BDAGIHXWWSANSR-UHFFFAOYSA-N
- 76002-91-0
MolClass #3673
NBLIPZBCGXIEFO-UHFFFAOYSA-N
- 74-83-9
MolClass #3674
GZUXJHMPEANEGY-UHFFFAOYSA-N
- 96346-61-1
MolClass #3675
IEXUMDBQLIVNHZ-UHFFFAOYSA-N
- 97975-05-8
MolClass #3676
NRZOXEUJFYCPSL-UHFFFAOYSA-N
- 123-72-8
MolClass #3677
ZTQSAGDEMFDKMZ-UHFFFAOYSA-N
- 87-68-3
MolClass #3678
RWNKSTSCBHKHTB-UHFFFAOYSA-N
- 25003-82-1
MolClass #3679
BIHVYFFSKHTVIG-UHFFFAOYSA-N
- 61064-66-2
MolClass #3680
KQEKDAKYDDKXTK-UHFFFAOYSA-N
- 18028-55-2
MolClass #3681
- 92130-56-8
MolClass #3682
RTJMFJILINJKAK-UHFFFAOYSA-N
- 480-54-6
MolClass #3683
BCJMNZRQJAVDLD-UHFFFAOYSA-N
- 712-12-9
MolClass #3684
DFUCHBBETXLBOR-UHFFFAOYSA-N
- 153-78-6
MolClass #3685
CFRFHWQYWJMEJN-UHFFFAOYSA-N
- 17309-86-3
MolClass #3686
- 49852-85-9
MolClass #3687
DMAOOKLAQXNHTK-UHFFFAOYSA-N
- 15254-64-5
MolClass #3688
MOSJDDFSMXUNCW-UHFFFAOYSA-N
- 513-85-9
MolClass #3689
OWBTYPJTUOEWEK-UHFFFAOYSA-N
- 41340-19-6
MolClass #3690
- 3811-71-0
MolClass #3691
ZPTZVNALDNIANP-UHFFFAOYSA-N
- 6534-28-7
MolClass #3692
KPHHXNVVLVNAMV-UHFFFAOYSA-N
- 357-57-3
MolClass #3693
RRKTZKIUPZVBMF-UHFFFAOYSA-N
- 83407-42-5
MolClass #3694
FAOPMOSOIJRQBP-UHFFFAOYSA-N
- 24953-56-8
MolClass #3695
GESPRUVYTLDFDD-UHFFFAOYSA-N
- 83905-01-5
MolClass #3696
MQTOSJVFKKJCRP-UHFFFAOYSA-N
- 321-14-2
MolClass #3697
NKBASRXWGAGQDP-UHFFFAOYSA-N
- 62641-67-2
MolClass #3698
VHNPZOQVSSWOJZ-UHFFFAOYSA-N
- 94500-44-4
MolClass #3699
NSEJACQEDMUEIJ-UHFFFAOYSA-N
- 6223-35-4
MolClass #3700
VIZXMHCBZLGUET-UHFFFAOYSA-N