General Information of the Compound
| Compound ID |
CP0576759
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| Compound Name |
3-(4-chlorophenyl)-N-(4-morpholin-4-ylphenyl)-4-oxophthalazine-1-carboxamide
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| Structure |
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| Formula |
C25H21ClN4O3
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| Molecular Weight |
460.921
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| Canonical SMILES |
Clc1ccc(cc1)-n1nc(C(=O)Nc2ccc(cc2)N2CCOCC2)c2ccccc2c1=O
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| InChI |
InChI=1S/C25H21ClN4O3/c26-17-5-9-20(10-6-17)30-25(32)22-4-2-1-3-21(22)23(28-30)24(31)27-18-7-11-19(12-8-18)29-13-15-33-16-14-29/h1-12H,13-16H2,(H,27,31)
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| InChIKey |
MBTBGWWJTWUHIO-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