General Information of the Compound
| Compound ID |
CP0921973
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| Compound Name |
(S)-N-(2,6-dichloro-4-(dimethylcarbamoyl)phenyl)-1,3-dioxo-2-((1S,2R)-2-phenylcyclopropyl)hexahydroimidazo[1,5-a]pyrazine-7(1H)-carboxamide
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| Structure |
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| Formula |
C25H25Cl2N5O4
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| Molecular Weight |
530.412
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| Canonical SMILES |
CN(C)C(=O)c1cc(Cl)c(NC(=O)N2CCN3C(=O)N([C@H]4C[C@@H]4c4ccccc4)C(=O)[C@@H]3C2)c(Cl)c1
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| InChI |
InChI=1S/C25H25Cl2N5O4/c1-29(2)22(33)15-10-17(26)21(18(27)11-15)28-24(35)30-8-9-31-20(13-30)23(34)32(25(31)36)19-12-16(19)14-6-4-3-5-7-14/h3-7,10-11,16,19-20H,8-9,12-13H2,1-2H3,(H,28,35)/t16-,19+,20+/m1/s1
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| InChIKey |
QZCVQRVVICEEFU-UXPWSPDFSA-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