General Information of the Compound
| Compound ID |
CP0370072
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| Compound Name |
US8575201, 15
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| Structure |
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| Formula |
C17H19N7O
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| Molecular Weight |
337.387
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| Canonical SMILES |
CN(C)c1nc(no1)C1(CCC1)c1ccc(nc1)-c1cnc(N)nc1
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| InChI |
InChI=1S/C17H19N7O/c1-24(2)16-22-14(23-25-16)17(6-3-7-17)12-4-5-13(19-10-12)11-8-20-15(18)21-9-11/h4-5,8-10H,3,6-7H2,1-2H3,(H2,18,20,21)
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| InChIKey |
NFSSFVUKSIEQIF-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