General Information of the Compound
| Compound ID |
CP0327036
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| Compound Name |
2-(1H-benzimidazol-2-yl)-1-phthalazinone
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| Structure |
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| Formula |
C15H10N4O
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| Molecular Weight |
262.272
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| Canonical SMILES |
O=c1n(ncc2ccccc12)-c1nc2ccccc2[nH]1
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| InChI |
InChI=1S/C15H10N4O/c20-14-11-6-2-1-5-10(11)9-16-19(14)15-17-12-7-3-4-8-13(12)18-15/h1-9H,(H,17,18)
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| InChIKey |
NIVVPIQJPNSGGS-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
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT06124, Paired box protein Pax-8