General Information of the Compound
| Compound ID |
CP0578337
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| Compound Name |
N,N-dibenzyl-3-(4-chlorophenyl)-4-oxophthalazine-1-carboxamide
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| Structure |
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| Formula |
C29H22ClN3O2
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| Molecular Weight |
479.967
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| Canonical SMILES |
Clc1ccc(cc1)-n1nc(C(=O)N(Cc2ccccc2)Cc2ccccc2)c2ccccc2c1=O
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| InChI |
InChI=1S/C29H22ClN3O2/c30-23-15-17-24(18-16-23)33-28(34)26-14-8-7-13-25(26)27(31-33)29(35)32(19-21-9-3-1-4-10-21)20-22-11-5-2-6-12-22/h1-18H,19-20H2
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| InChIKey |
XGNPYPJXBPJPFE-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