Compound Search
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基于 PubChem CID 索引，支持名称 / 同义词 / CAS / SMILES 检索。
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Hydrogen bis((2,2'-iminobis(ethanolato))(2-)-O,O')borate(1-), compound with 6-(methyl(phenylsulphonyl)amino)hexanoic acid (1:1) CAS 94247-66-2 PubChem CID 71300535
C1CO[B-]2(OCCN1)OCCNCCO2.CN(CCCCCC(=O)O)S(=O)(=O)c1ccccc1.[H+] -
(Z)-3-[2-(Carboxymethyl)dibenzo[b,e]oxepin-11(6H)-ylidene]-N,N-dimethylpropan-1-amine Oxide (Olopatadine N-Oxide) CAS 203188-31-2 PubChem CID 71433979
C[N+](C)([O-])CCC=C1c2ccccc2COc2ccc(CC(=O)O)cc21 -
US9725442, Compound I-31 PubChem CID 71556119
CC(C)Oc1ccc(S(=O)(=O)N2C[C@H](C)[C@@H](n3nc(CC(=O)O)c4ccc(F)cc43)C2)cc1 -
(S)-6-METHOXY-.ALPHA.-METHYLNAPHTHALENE-2-ACETIC ACID, COMPOUND WITH PIPERAZINE (2:1) CAS 70981-66-7 PubChem CID 76968825
C1CNCCN1.COc1ccc2cc([C@H](C)C(=O)O)ccc2c1.COc1ccc2cc([C@H](C)C(=O)O)ccc2c1 -
US10272079, Compound 47 PubChem CID 90077841
O=C(NCCCCNC(=O)NCCOCCOCCNS(=O)(=O)c1ccc(O[C@H]2c3ccccc3C[C@@H]2N2CCCCC2)cc1)NCCOCCOCCNS(=O)(=O)c1ccc(O[C@H]2c3ccccc3C[C@@H]2N2CCCCC2)cc1 -
cyclopropyl([(3R,4S) or (3S,4R)]-3-(difluoromethyl)-4- ((9-ethyl-8-(2-methylpyrimidin- 5-yl)-9H-purin-6- yl)oxy)pyrrolidin-1- yl)methanone PubChem CID 90166662
CCn1c(-c2cnc(C)nc2)nc2c(OC3CN(C(=O)C4CC4)CC3C(F)F)ncnc21 -
4-(9-(4-fluorophenoxy)- 8,9-dihydro-7H-6-oxa- 1,2,2a1- triazabenzo[cd]azulen-4- yl)-N-(1-methyl-1H- pyrazol-5-yl)pyrimidin-2- amine PubChem CID 118143148
Cn1nccc1Nc1nccc(-c2cc3n4c(nnc4c2)C(Oc2ccc(F)cc2)CCO3)n1 -
(S)-1-(3-(2-(1-((6-amino-5-cyanopyrimidin-4-yl)amino)ethyl)-8-chloro-4-oxoquinazolin-3(4H)-yl)phenyl)-3-(3-hydroxypropyl)urea PubChem CID 118571462
C[C@H](Nc1ncnc(N)c1C#N)c1nc2c(F)ccc(Cl)c2c(=O)n1-c1cccc(NC(=O)NCCCO)c1 -
Nc1noc2nc(Cl)c(F)cc12 -
(S)-1-(((1R,3r,5S)-6,6-difluorobicyclo[3.1.0]hexan-3-yl)methyl)-4-(3-(methylsulfonyl)phenyl)-2-phenylpiperazine PubChem CID 118883576
CS(=O)(=O)c1cccc(N2CCN(CC3C[C@@H]4[C@H](C3)C4(F)F)[C@@H](c3ccccc3)C2)c1 -
Dodecanedioic acid, compound with N-(2-aminoethyl)-N'-(2-((2-aminoethyl)amino)ethyl)ethane-1,2-diamine and 2,2'-iminodiethanol CAS 84238-66-4 PubChem CID 119057632
NCCNCCNCCNCCN.O=C(O)CCCCCCCCCCC(=O)O.OCCNCCO -
[3-[4-(Aminomethyl)-6-(trifluoromethyl)pyridin-2-yl]oxyphenyl]-[4-(hydroxymethyl)piperidin-1-yl]methanone PubChem CID 122516806
NCc1cc(Oc2cccc(C(=O)N3CCC(CO)CC3)c2)nc(C(F)(F)F)c1 -
US9815850, Compound 173 PubChem CID 130299003
CN1C(=O)[C@@H](NC(=O)c2nnc(C3(c4ccccc4)CC3)o2)COc2cccnc21 -
(R or S)-5-(9-ethyl-8-(2- methylpyrimidin-5-yl)-9H- purin-6-yl)-3- (isobutylamino)-3- methylindolin-2-one PubChem CID 131964577
CCn1c(-c2cnc(C)nc2)nc2c(-c3ccc4c(c3)C(C)(NCC(C)C)C(=O)N4)ncnc21 -
cis-N-(8-amino-6-(4-ethyl-6- methoxypyridin-3-yl)-2,7-naphthyridin-3- yl)-2-fluorocyclopropanecarboxamide PubChem CID 135344442
CCc1cc(OC)ncc1-c1cc2cc(NC(=O)[C@@H]3C[C@@H]3F)ncc2c(N)n1 -
(R)-1-methyl-N-(5-(5-methyl-1,2,4- oxadiazol-3-yl)-2,3-dihydro-1H- inden-1-yl)-1H-pyrazole-4- carboxamide PubChem CID 139412231
Cc1nc(-c2ccc3c(c2)CC[C@H]3NC(=O)c2cnn(C)c2)no1 -
4-(9-(4-fluorophenoxy)- 8,9-dihydro-7H-6-oxa- 1,2,2a1- triazabenzo[cd]azulen-4- yl)-N-(1-methyl-1H- pyrazol-5-yl)pyrimidin-2- amine PubChem CID 145713262
Cn1nccc1Nc1nccc(-c2cc3n4c(nnc4c2)[C@H](Oc2ccc(F)cc2)CCO3)n1 -
4-(9-(4-fluorophenoxy)- 8,9-dihydro-7H-6-oxa- 1,2,2a1- triazabenzo[cd]azulen-4- yl)-N-(1-methyl-1H- pyrazol-5-yl)pyrimidin-2- amine PubChem CID 145995662
Cn1nccc1Nc1nccc(-c2cc3n4c(nnc4c2)[C@@H](Oc2ccc(F)cc2)CCO3)n1 -
US11414431, Compound I-442 PubChem CID 146559129
CNc1cc(Nc2cccn(C3CC(F)C3)c2=O)nc2c(C(=O)N[C@@H]3CC[C@@H](OC)C3)cnn12 -
7-Methoxy-10-oxo-7-[3-(trifluoromethyl)pyridin-2-yl]spiro[4.5]dec-8-ene-9-carbonitrile PubChem CID 146692139
COC1(c2ncccc2C(F)(F)F)C=C(C#N)C(=O)C2(CCCC2)C1