General Information of the Compound
| Compound ID |
CP0960896
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| Compound Name |
US9200001, 89
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| Structure |
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| Formula |
C19H19N7
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| Molecular Weight |
345.41
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| Canonical SMILES |
Cc1nc([C@@H]2C[C@H]2c2nc3ccccc3[nH]2)cc(-n2nc(C)nc2C)n1
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| InChI |
InChI=1S/C19H19N7/c1-10-21-17(9-18(22-10)26-12(3)20-11(2)25-26)13-8-14(13)19-23-15-6-4-5-7-16(15)24-19/h4-7,9,13-14H,8H2,1-3H3,(H,23,24)/t13-,14-/m1/s1
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| InChIKey |
ZTLVEGLVKIXHIK-ZIAGYGMSSA-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