General Information of the Compound
| Compound ID |
CP0255862
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| Compound Name |
BMS-564929
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| Synonyms |
2-Chloro-3-methyl-4-[(7R,7AS)-tetrahydro-7-hydroxy-1,3-dioxo-1H-pyrrolo[1,2-c]imidazol-2(3H)-yl]benzonitrile
2-Chloro-4-[(7r,7as)-7-Hydroxy-1,3-Dioxotetrahydro-1h-Pyrrolo[1,2-C]imidazol-2(3h)-Yl]-3-Methylbenzonitrile
2nw4
3500AH
627530-84-1
8NH
9BLW27W4X7
AKOS027288930
BMS 564929
BMS 564929;BMS564929
BMS-564,929
BMS-564929
C14H12ClN3O3
CS-1381
DB07286
DTXSID50432357
HY-12111
KB-75607
KEJORAMIZFOODM-PWSUYJOCSA-N
NCGC00378909-01
S900006120
SCHEMBL2967577
UNII-9BLW27W4X7
W-5594
ZINC3938678
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| Structure |
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| Formula |
C14H12ClN3O3
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| Molecular Weight |
305.721
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| Canonical SMILES |
Cc1c(Cl)c(ccc1N1C(=O)[C@@H]2[C@H](O)CCN2C1=O)C#N
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| InChI |
InChI=1S/C14H12ClN3O3/c1-7-9(3-2-8(6-16)11(7)15)18-13(20)12-10(19)4-5-17(12)14(18)21/h2-3,10,12,19H,4-5H2,1H3/t10-,12+/m1/s1
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| InChIKey |
KEJORAMIZFOODM-PWSUYJOCSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01577, Androgen receptor
Protein ID: PT00894, Androgen receptor
Protein ID: PT01486, Androgen receptor
Clinical Information about the Compound