General Information of the Compound
| Compound ID |
CP0374213
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| Compound Name |
(R)-(4-(4-(1H-imidazol-1-yl)phthalazin-1-yl)-3-methylpiperazin-1-yl)(phenyl)methanone
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| Structure |
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| Formula |
C23H22N6O
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| Molecular Weight |
398.47
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| Canonical SMILES |
C[C@@H]1CN(CCN1c1nnc(-n2ccnc2)c2ccccc12)C(=O)c1ccccc1
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| InChI |
InChI=1S/C23H22N6O/c1-17-15-27(23(30)18-7-3-2-4-8-18)13-14-29(17)22-20-10-6-5-9-19(20)21(25-26-22)28-12-11-24-16-28/h2-12,16-17H,13-15H2,1H3/t17-/m1/s1
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| InChIKey |
FVCGGSFOMIGHEE-QGZVFWFLSA-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