General Information of the Compound
| Compound ID |
CP0578201
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| Compound Name |
2-(cyclopropylamino)-3-[4-[(2,5-dichlorophenyl)methyl]piperazin-1-yl]-N,N-dimethylquinoxaline-6-carboxamide
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| Structure |
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| Formula |
C25H28Cl2N6O
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| Molecular Weight |
499.446
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| Canonical SMILES |
CN(C)C(=O)c1ccc2nc(NC3CC3)c(nc2c1)N1CCN(Cc2cc(Cl)ccc2Cl)CC1
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| InChI |
InChI=1S/C25H28Cl2N6O/c1-31(2)25(34)16-3-8-21-22(14-16)30-24(23(29-21)28-19-5-6-19)33-11-9-32(10-12-33)15-17-13-18(26)4-7-20(17)27/h3-4,7-8,13-14,19H,5-6,9-12,15H2,1-2H3,(H,28,29)
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| InChIKey |
ZRJUZVAOHUELSK-UHFFFAOYSA-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