General Information of the Compound
| Compound ID |
CP0543748
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| Compound Name |
N-benzhydryl-3-(4-chlorophenyl)-4-oxophthalazine-1-carboxamide
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| Structure |
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| Formula |
C28H20ClN3O2
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| Molecular Weight |
465.94
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| Canonical SMILES |
Clc1ccc(cc1)-n1nc(C(=O)NC(c2ccccc2)c2ccccc2)c2ccccc2c1=O
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| InChI |
InChI=1S/C28H20ClN3O2/c29-21-15-17-22(18-16-21)32-28(34)24-14-8-7-13-23(24)26(31-32)27(33)30-25(19-9-3-1-4-10-19)20-11-5-2-6-12-20/h1-18,25H,(H,30,33)
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| InChIKey |
AHWYXQOZGKLVRS-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