General Information of the Compound
| Compound ID |
CP0533363
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| Compound Name |
5-cyclopropyl-3-[(2-phenyltriazol-4-yl)methyl]triazolo[4,5-d]pyrimidin-7-amine
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| Structure |
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| Formula |
C16H15N9
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| Molecular Weight |
333.359
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| Canonical SMILES |
Nc1nc(nc2n(Cc3cnn(n3)-c3ccccc3)nnc12)C1CC1
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| InChI |
InChI=1S/C16H15N9/c17-14-13-16(20-15(19-14)10-6-7-10)24(23-21-13)9-11-8-18-25(22-11)12-4-2-1-3-5-12/h1-5,8,10H,6-7,9H2,(H2,17,19,20)
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| InChIKey |
FEPSZRUGGUYXCP-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