Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- BTB 02837
MolClass #61478
XLYLRFKZDULVOC-UHFFFAOYSA-N
- CD 10980
MolClass #61564
YXUKJPWWNDXVOT-UHFFFAOYSA-N
- SEW 05604
MolClass #61619
BLPOFXABFGQLSX-UHFFFAOYSA-N
- HAN 00116
MolClass #61646
VAMQLZCXRXXOSK-UHFFFAOYSA-N
- JFD 03196
MolClass #61669
VFORUARCDXMTQI-UHFFFAOYSA-N
- S 14530
MolClass #61691
QUIIIYITNGOFEI-UHFFFAOYSA-N
- S 14685
MolClass #61692
ZOQSXBXNFXEJQF-UHFFFAOYSA-N
- KM 07869
MolClass #61740
DMPHPSHGWNYPAH-UHFFFAOYSA-N
- RDR 03443
MolClass #61747
GVCMOCXVYHGACV-UHFFFAOYSA-N
- SJC 00146
MolClass #61766
RJPKSLSMUNOOIQ-FBCYGCLPSA-N
- GK 00584
MolClass #61802
LGBIXGHNONFFHW-UHFFFAOYSA-N
- JFD 01482
MolClass #61813
BGGCPIFVRJFAKF-UHFFFAOYSA-N
- S 02724
MolClass #61840
OZGQERGWDXSRQR-UHFFFAOYSA-N
- CD 09553
MolClass #61876
YYFJFAIVVWKQND-UHFFFAOYSA-N
- RH 00511
MolClass #61982
LYNOGBKNFIHKLE-UHFFFAOYSA-N
- SP 01461
MolClass #62002
VJLHVRCCUBNGJU-UHFFFAOYSA-N
- CD 02761
MolClass #62020
FQOWGRDYETTXQY-UHFFFAOYSA-N
- BTB 14887
MolClass #62095
WLKOJUHWQSYYGG-UHFFFAOYSA-N
- HTS 00031
MolClass #62109
UHTILJKZSOYRID-UHFFFAOYSA-N
- KM 06839
MolClass #62128
LVYSUFFNCAUSNI-UHFFFAOYSA-N
- HTS 05583
MolClass #62188
WGOUNLOZSDTBJW-UHFFFAOYSA-N
- JFD 00597
MolClass #62199
IXNJYCJHWQGZIN-UHFFFAOYSA-N
- KM 00313
MolClass #62201
XGPGKTCJSGYXCY-PFONDFGASA-N
- RJC 00145
MolClass #62219
ZNSDCNJMPKNYLO-CSKARUKUSA-N
- S 04434
MolClass #62222
NNBAXWAPIROUSM-UHFFFAOYSA-N
- SPB 07561
MolClass #62236
LMOPSARPJQLGHE-UHFFFAOYSA-N
- MBE 00173
MolClass #62277
VCAXTBYOGVOFHQ-UHFFFAOYSA-N
- S 14963
MolClass #62299
BWLIIZFNXSJVLW-VOTSOKGWSA-N
- SPB 02109
MolClass #62310
NFQBECYKFWDRLL-UHFFFAOYSA-N
- RH 00102
MolClass #62364
DYPFPPGNJPPASW-UHFFFAOYSA-N
- SPB 03084
MolClass #62388
NSTWPGVMXNZWJY-UHFFFAOYSA-N
- KM 05969
MolClass #62429
MQWFFVLHXWGVFQ-UKTHLTGXSA-N
- KM 06890
MolClass #62431
XYAIMELRJWBNHR-UHFFFAOYSA-N
- RJC 02395
MolClass #62448
NBPUQEMBAAXTHA-UHFFFAOYSA-N
- S 07624
MolClass #62451
BCLXYIADRSPQJP-UHFFFAOYSA-N
- BTB 05499
MolClass #62474
NXCJXULEOBNDOE-UHFFFAOYSA-N
- SPB 06166
MolClass #62539
PJPKLBMSZBCHAU-UHFFFAOYSA-N
- BTB 12794
MolClass #62554
XAAPDJDEQUCOGM-UHFFFAOYSA-N
- RDR 03998
MolClass #62592
KHNMPUHBSWOSEA-UHFFFAOYSA-N
- RJC 00392
MolClass #62594
KQECNCYMEFZLNX-UHFFFAOYSA-N
- SEW 00893
MolClass #62609
COLXIZNKGPZCLV-UHFFFAOYSA-N
- RF 05391
MolClass #62673
VSZVAGCJFVDCKZ-UHFFFAOYSA-N
- RH 00127
MolClass #62675
MZPPFINMZVZPNJ-UHFFFAOYSA-N
- RJF 00959
MolClass #62680
SHWBASTYCBOBMK-CXUHLZMHSA-N
- KM 09585
MolClass #62811
FSALVIRWLGDVGC-UHFFFAOYSA-N
- SEW 05288
MolClass #62916
JCZHTZRHTXQQRS-MDWZMJQESA-N
- BTB 03261
MolClass #62928
LESLCWDCJBSMJG-UHFFFAOYSA-N
- SEW 04277
MolClass #62981
XPRCJJCNXHXPIN-UHFFFAOYSA-N
- SPB 00832
MolClass #62987
DFLMLCPJNMPWNU-UHFFFAOYSA-N
- CD 04007
MolClass #63002
OLRJFSAJFJLBHC-UHFFFAOYSA-N
- S 11423
MolClass #63058
YQPHJQROGCTWQA-UHFFFAOYSA-N
- SPB 05385
MolClass #63228
ZXQSGOZIDCTQEC-UHFFFAOYSA-N
- SEW 04981
MolClass #63377
VFGZASZXLDMQJH-UHFFFAOYSA-N
- HTS 01833
MolClass #63401
YLCSCAQFQSZDOU-UHFFFAOYSA-N
- BTB 14690
MolClass #63467
ATHTWVZNAHADCL-UHFFFAOYSA-N
- HTS 07816
MolClass #63488
BUXPTMYUIMEKBI-UHFFFAOYSA-N
- KM 06626
MolClass #63505
WERXUKHHNJYRLU-UHFFFAOYSA-N
- KM 09752
MolClass #63507
SRBOMPONPKHIHB-UHFFFAOYSA-N
- BTB 07221
MolClass #63542
SCGUDKCEFAZIKN-UHFFFAOYSA-N
- JFD 03446
MolClass #63571
UOZOVCJOEFHKCA-UHFFFAOYSA-N
- PHG 01048
MolClass #63654
GDXDDRCXLQWXJT-UHFFFAOYSA-N
- SPB 00514
MolClass #63678
DCHNOYBTWGJUIC-UHFFFAOYSA-N
- AW 00837
MolClass #63690
QLWCXWZCXMTOMG-UHFFFAOYSA-N
- SP 01416
MolClass #63837
PSBOUGLMMMITRO-UHFFFAOYSA-N
- SPB 01822
MolClass #63838
XDNWFOXDIVRKCD-UHFFFAOYSA-N
- CD 04975
MolClass #64006
RBXSHTPRUGKWLA-RIYZIHGNSA-N
- CD 11359
MolClass #64010
XZVWQNJJRGGNEL-UHFFFAOYSA-N
- KM 06421
MolClass #64033
KQMZARDGULMLIY-FOKLQQMPSA-N
- SP 00190
MolClass #64062
PSSYQYPUOPHYTA-UHFFFAOYSA-N
- SEW 02839
MolClass #64139
AHLPEWBLLUQGPA-UHFFFAOYSA-N
- HAN 00057
MolClass #64164
OPVOBTHCDJLBPT-UHFFFAOYSA-N
- HTS 01945
MolClass #64165
ROEWWYWJGUEKOA-UHFFFAOYSA-N
- SEW 03989
MolClass #64202
WOHGNYMTJUDFHF-UHFFFAOYSA-N
- SPB 03924
MolClass #64213
WSQUCFZEYASUKU-UHFFFAOYSA-N
- BTBG 00139
MolClass #64315
JYFGIESQUYQLGM-UHFFFAOYSA-N
- DSHS 00690
MolClass #64325
MUQSIRWRHGVDBP-UHFFFAOYSA-N
- CD 02621
MolClass #64384
VYTUHDRNUQJZOZ-UHFFFAOYSA-N
- CD 04583
MolClass #64386
MEMDOEYTELXXAV-UHFFFAOYSA-N
- SPB 01640
MolClass #64446
MKQAJOYCHFCZLC-UHFFFAOYSA-N
- BTB 02101
MolClass #64605
XIDGHCYMXVCMSS-UHFFFAOYSA-N
- HTS 01769
MolClass #64695
VPAMHQANZDTESU-UHFFFAOYSA-N
- RF 05106
MolClass #64730
TYJJIPLMAWAJRR-UHFFFAOYSA-N
- RJC 02988
MolClass #64737
YXORNPYTQVCSAC-UHFFFAOYSA-N
- SPB 07211
MolClass #64756
NNMAOGUXRCJFIY-UHFFFAOYSA-N
- DP 00481
MolClass #64856
DOQDNMZNLGZKFI-UHFFFAOYSA-N
- SEW 02506
MolClass #64902
OBTTUFNMJBRFOH-UHFFFAOYSA-N
- SEW 02632
MolClass #64903
BTOMWPBXZNHDIL-UHFFFAOYSA-N
- SEW 02817
MolClass #64905
PUQOGWCVZFTMRQ-UHFFFAOYSA-N
- BTBG 00201
MolClass #64923
YJXGFSAKPYAXAY-UHFFFAOYSA-N
- RDR 00515
MolClass #64969
WOUPLZKWNBINRL-UHFFFAOYSA-N
- RF 03874
MolClass #64972
UCZYOPOUMJDWBU-LFIBNONCSA-N
- S 12357
MolClass #64983
MALVOABWAGKNIK-UHFFFAOYSA-N
- SEW 01391
MolClass #64985
UTWHUWNLJDBYFR-UHFFFAOYSA-N
- GK 02387
MolClass #65003
DJFDAUQGWKZKIP-UHFFFAOYSA-N
- CD 10699
MolClass #65080
VOANLBOQGYULFI-UHFFFAOYSA-N
- DP 00477
MolClass #65081
JBTPUMQIJZGWRT-UHFFFAOYSA-N
- JFD 03398
MolClass #65175
JJKLELBOXAKAAD-UHFFFAOYSA-N
- CD 09658
MolClass #65240
FZAXBDIMOOZDLW-UHFFFAOYSA-N
- SEW 03396
MolClass #65291
RHKPXWROQDTAQI-UVTDQMKNSA-N
- S 10991
MolClass #65364
BKLSHYMRBHFIAN-HNQUOIGGSA-N