General Information of the Compound
| Compound ID |
CP0374749
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| Compound Name |
4-[(2-aminophenyl)methyl]-2H-phthalazin-1-one
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| Structure |
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| Formula |
C15H13N3O
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| Molecular Weight |
251.289
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| Canonical SMILES |
Nc1ccccc1Cc1n[nH]c(=O)c2ccccc12
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| InChI |
InChI=1S/C15H13N3O/c16-13-8-4-1-5-10(13)9-14-11-6-2-3-7-12(11)15(19)18-17-14/h1-8H,9,16H2,(H,18,19)
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| InChIKey |
PJBBZWKKSCFNFZ-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