Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- Praziquantel
MolClass #9201
FSVJFNAIGNNGKK-QGZVFWFLSA-N
- Trimetrexate
MolClass #9202
NOYPYLRCIDNJJB-UHFFFAOYSA-N
- Trometamol
MolClass #9203
LENZDBCJOHFCAS-UHFFFAOYSA-N
- Trovafloxacin
MolClass #9204
WVPSKSLAZQPAKQ-QWRGUYRKSA-N
- Atropine
MolClass #9205
RKUNBYITZUJHSG-QXULXFAOSA-N
- Azithromycin
MolClass #9206
MQTOSJVFKKJCRP-KGEVOQJASA-N
- Bacitracin
MolClass #9207
- Bethanechol
MolClass #9208
NZUPCNDJBJXXRF-LURJTMIESA-O
- Bromocriptine
MolClass #9209
- Buprenorphine
MolClass #9210
RMRJXGBAOAMLHD-IHFGGWKQSA-N
- Bupropion
MolClass #9211
SNPPWIUOZRMYNY-VIFPVBQESA-N
- Carbenicillin
MolClass #9212
GZZSMSBGWUCDEM-AYGWYOGXSA-N
- Cefradine
MolClass #9213
RDLPVSKMFDYCOR-PGUXBMHVSA-N
- Chloroquine
MolClass #9214
WHTVZRBIWZFKQO-CQSZACIVSA-N
- Cisapride
MolClass #9215
DCSUBABJRXZOMT-UNMCSNQZSA-N
- Cladribine
MolClass #9216
PTOAARAWEBMLNO-YSLANXFLSA-N
- Clidiniumbromide
MolClass #9217
QWLXOYPJRDOJFF-WBUXBCECSA-N
- Clofazimine
MolClass #9218
WDQPAMHFFCXSNU-KRUMMXJUSA-N
- Dextromethorphan
MolClass #9219
MKXZASYAUGDDCJ-KBAYOESNSA-N
- Cromoglicicacid
MolClass #9220
YLHNDNMXYPRVNI-UHFFFAOYSA-N
- Ganciclovir
MolClass #9221
- Ipratropiumbromide
MolClass #9222
OEXHQOGQTVQTAT-SSZRJXQFSA-N
- Itraconazole
MolClass #9223
VHVPQPYKVGDNFY-DKYCYSLVSA-N
- Kanamycin
MolClass #9224
SBUJHOSQTJFQJX-SWHIJRROSA-N
- Ketorolac
MolClass #9225
OZWKMVRBQXNZKK-LLVKDONJSA-N
- Mannitol
MolClass #9226
FBPFZTCFMRRESA-KVTDHHQDSA-N
- Mepenzolatebromide
MolClass #9227
HCUNPWITRQUHPE-IBGZPJMESA-N
- Methotrexate
MolClass #9228
FBOZXECLQNJBKD-ZDUSSCGKSA-N
- Metoprolol
MolClass #9229
IUBSYMUCCVWXPE-CQSZACIVSA-N
- Minocycline
MolClass #9230
DYKFCLLONBREIL-KVUCHLLUSA-N
- Moclobemide
MolClass #9231
YHXISWVBGDMDLQ-UHFFFAOYSA-N
- Ribavirin
MolClass #9232
XAZIMCJWLQZWBM-UAKXSSHOSA-N
- Ritonavir
MolClass #9233
NCDNCNXCDXHOMX-XGKFQTDJSA-N
- Sevoflurane
MolClass #9234
DFEYYRMXOJXZRJ-UHFFFAOYSA-N
- Sodiumamidotrizoate
MolClass #9235
CFAHZQBEUQAWFC-UHFFFAOYSA-N
- Sotalol
MolClass #9236
ZBMZVLHSJCTVON-GFCCVEGCSA-N
- Stavudine
MolClass #9237
- Streptomycin
MolClass #9238
UCSJYZPVAKXKNQ-ZCTIVXDHSA-N
- Tamoxifen
MolClass #9239
NKANXQFJJICGDU-OCEACIFDSA-N
- Temazepam
MolClass #9240
SEQDDYPDSLOBDC-HNNXBMFYSA-N
- Ticarcillin
MolClass #9241
DHXMSZODZSWDDM-RGNHYFCHSA-N
- Topotecan
MolClass #9242
UCFGDBYHRUNTLO-QHCPKHFHSA-N
- Zonisamide
MolClass #9243
UBQNRHZMVUUOMG-UHFFFAOYSA-N
- AmphotericinB
MolClass #9244
APKFDSVGJQXUKY-XQGQVYCLSA-N
- Calcium-folinate
MolClass #9245
VVIAGPKUTFNRDU-OLZOCXBDSA-L
- Ceftazidime
MolClass #9246
IICPVTXOSIIEKY-VEUDKXNTSA-N
- Guanadrel
MolClass #9247
HPBNRIOWIXYZFK-QMMMGPOBSA-N
- Mesna
MolClass #9248
ZNEWHQLOPFWXOF-UHFFFAOYSA-M
- Streptozotocin
MolClass #9249
ZSJLQEPLLKMAKR-NYMZXIIRSA-N
- Teniposide
MolClass #9250
HFNGFXBXLSRAKX-LZBRCCHTSA-N
- Vancomycin
MolClass #9251
MYPYJXKWCTUITO-RBTVVTRKSA-N
- Desmonomethylpromazine
MolClass #9252
WOCOVPRTRIBGFZ-UHFFFAOYSA-N
- BBcpd60
MolClass #9253
- Bis-hydroxylated-L-663581
MolClass #9254
OBUWKSYNYYMZNZ-UHFFFAOYSA-N
- Mono-hydroxylated-L-663581
MolClass #9255
XHMYQXZLVLGNKX-UHFFFAOYSA-N
- Thioperamide
MolClass #9256
- Mefloquine
MolClass #9257
XEEQGYMUWCZPDN-DOMZBBRYSA-N
- Ofloxacin
MolClass #9258
LYAJZPCTCZPCPF-SNVBAGLBSA-N
- Tifluadom
MolClass #9259
RWJNKNFUNQGDEQ-JOCHJYFZSA-N
- aldosterone
MolClass #9260
PQSUYGKTWSAVDQ-ZVIOFETBSA-N
- apomorphine_r
MolClass #9261
VMWNQDUVQKEIOC-ZDUSSCGKSA-N
- BRL52537
MolClass #9262
GHCCBWMZKJQGLS-HNNXBMFYSA-N
- BRL52580
MolClass #9263
ATTHVGBIVYJECI-OAQYLSRUSA-N
- BRL52656
MolClass #9264
RFTWMVGLYKJUCZ-KRWDZBQOSA-N
- BRL52871
MolClass #9265
HTWGECPQHCRGFE-GOSISDBHSA-N
- BRL52974
MolClass #9266
- BRL53080
MolClass #9267
UFRFKPDRMYNUAU-GOSISDBHSA-N
- BRL53087
MolClass #9268
DCFFMOYFRXJGII-MRXNPFEDSA-N
- carebastine
MolClass #9269
XGHOVGYJHWQGCC-UHFFFAOYSA-N
- cetirizine
MolClass #9270
ZKLPARSLTMPFCP-OAQYLSRUSA-N
- corticosterone
MolClass #9271
OMFXVFTZEKFJBZ-IIJALIKYSA-N
- cp102
MolClass #9272
QEUNHAYEJPIRIA-UHFFFAOYSA-N
- cp107
MolClass #9273
PGAVJEVPRWLSBG-UHFFFAOYSA-N
- cp20
MolClass #9274
TZXKOCQBRNJULO-UHFFFAOYSA-N
- cp21
MolClass #9275
LCWFIBYPSAWVLI-UHFFFAOYSA-N
- cp24
MolClass #9276
YYJBZFVEZYRNEW-UHFFFAOYSA-N
- cp25
MolClass #9277
UJMBXXIGVFMNDN-UHFFFAOYSA-N
- cp29
MolClass #9278
CDKSMVGMMHOIEM-UHFFFAOYSA-N
- cp41
MolClass #9279
MZTICZXVUWMKNM-UHFFFAOYSA-N
- cp94
MolClass #9280
XIYFEESCIBNMIC-UHFFFAOYSA-N
- Cyclazocine
MolClass #9281
YQYVFVRQLZMJKJ-NXOUGTEYSA-N
- difloxacin
MolClass #9282
NOCJXYPHIIZEHN-UHFFFAOYSA-N
- Org13011
MolClass #9283
YKJJCYZZWWSBEW-UHFFFAOYSA-N
- EMD60400
MolClass #9284
SYMWUCVROYSIKP-QUCCMNQESA-N
- flupentixol
MolClass #9285
NJMYODHXAKYRHW-BLLMUTORSA-N
- GR85571
MolClass #9286
IMYIXKWHJNYXNZ-INIZCTEOSA-N
- GR88377
MolClass #9287
NZBGPQIBCIBEQA-GOSISDBHSA-N
- GR89696
MolClass #9288
HJUAKZYKCANOOZ-HNNXBMFYSA-N
- GR89696_et
MolClass #9289
NAILEPLTGOUWNK-INIZCTEOSA-N
- GR89696_pr
MolClass #9290
ZRGBDBQNZKZFDL-KRWDZBQOSA-N
- GR91272
MolClass #9291
FGHHKXQJPIQMCC-RDTXWAMCSA-N
- GR94839
MolClass #9292
ZFWNCCCNZIYJAQ-JKSUJKDBSA-N
- GR94839_A
MolClass #9293
OPDMINTXIOYZMU-ZWKOTPCHSA-N
- GR94839_B
MolClass #9294
RVMJEGUPDTVYDF-ZWKOTPCHSA-N
- GR94839_C
MolClass #9295
WLZKXQIQNDDGFA-ZWKOTPCHSA-N
- GR94839_D
MolClass #9296
HVIIWHNRMPBXJH-ZWKOTPCHSA-N
- GR94839_E
MolClass #9297
PEQOZYFAQULPER-ROUUACIJSA-N
- GR94839_F
MolClass #9298
KPROYTOCROSGBH-ZWKOTPCHSA-N
- GR94839_G
MolClass #9299
ORHHLDSDCYBOHB-ROUUACIJSA-N
- GR94839_H
MolClass #9300
DOKIXXRTJKWZED-ZWKOTPCHSA-N