General Information of the Compound
| Compound ID |
CP0512362
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| Compound Name |
US9434725, 313
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| Structure |
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| Formula |
C19H19N9
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| Molecular Weight |
373.424
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| Canonical SMILES |
Cc1cncc(n1)-c1cc2n(ncc2nn1)-c1cccc(n1)N1CCNCC1
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| InChI |
InChI=1S/C19H19N9/c1-13-10-21-11-15(23-13)14-9-17-16(26-25-14)12-22-28(17)19-4-2-3-18(24-19)27-7-5-20-6-8-27/h2-4,9-12,20H,5-8H2,1H3
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| InChIKey |
SJECHZVGJJSCJC-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