General Information of the Compound
| Compound ID |
CP0247495
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| Compound Name |
4-[[4-(4-chlorophenyl)phthalazin-1-yl]amino]benzenesulfonamide
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| Structure |
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| Formula |
C20H15ClN4O2S
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| Molecular Weight |
410.886
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| Canonical SMILES |
NS(=O)(=O)c1ccc(Nc2nnc(-c3ccc(Cl)cc3)c3ccccc23)cc1
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| InChI |
InChI=1S/C20H15ClN4O2S/c21-14-7-5-13(6-8-14)19-17-3-1-2-4-18(17)20(25-24-19)23-15-9-11-16(12-10-15)28(22,26)27/h1-12H,(H,23,25)(H2,22,26,27)
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| InChIKey |
ZRCVCVJPVIGDRB-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