General Information of the Compound
| Compound ID |
CP0456025
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| Compound Name |
US9199981, F170
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| Structure |
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| Formula |
C24H26N6O3
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| Molecular Weight |
446.511
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| Canonical SMILES |
Cc1ccc(cc1NC(=O)c1cnc2ccccn12)-c1noc(n1)C1CC(C1)NCCCO
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| InChI |
InChI=1S/C24H26N6O3/c1-15-6-7-16(22-28-24(33-29-22)17-11-18(12-17)25-8-4-10-31)13-19(15)27-23(32)20-14-26-21-5-2-3-9-30(20)21/h2-3,5-7,9,13-14,17-18,25,31H,4,8,10-12H2,1H3,(H,27,32)
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| InChIKey |
SCWVNKLMZABQLA-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