General Information of the Compound
| Compound ID |
CP0389845
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| Compound Name |
(E)-3-(4-chlorophenyl)-N-[2-[cyclopentyl(methyl)amino]-4-methylquinazolin-6-yl]prop-2-enamide
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| Structure |
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| Formula |
C24H25ClN4O
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| Molecular Weight |
420.944
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| Canonical SMILES |
CN(C1CCCC1)c1nc(C)c2cc(NC(=O)\C=C\c3ccc(Cl)cc3)ccc2n1
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| InChI |
InChI=1S/C24H25ClN4O/c1-16-21-15-19(27-23(30)14-9-17-7-10-18(25)11-8-17)12-13-22(21)28-24(26-16)29(2)20-5-3-4-6-20/h7-15,20H,3-6H2,1-2H3,(H,27,30)/b14-9+
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| InChIKey |
IPSZMQXNYKYOEZ-NTEUORMPSA-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