General Information of the Compound
| Compound ID |
CP0561762
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| Compound Name |
1-[(4-methylphenyl)methyl]benzotriazole-5-carboxamide
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| Structure |
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| Formula |
C15H14N4O
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| Molecular Weight |
266.304
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| Canonical SMILES |
Cc1ccc(Cn2nnc3cc(ccc23)C(N)=O)cc1
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| InChI |
InChI=1S/C15H14N4O/c1-10-2-4-11(5-3-10)9-19-14-7-6-12(15(16)20)8-13(14)17-18-19/h2-8H,9H2,1H3,(H2,16,20)
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| InChIKey |
MUVXJTHQYDWBAM-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