General Information of the Compound
| Compound ID |
CP0549905
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| Compound Name |
US9199981, F159
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| Structure |
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| Formula |
C20H17N5O3
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| Molecular Weight |
375.388
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| Canonical SMILES |
Cc1ccc(cc1NC(=O)c1cnc2ccccn12)-c1noc(n1)C1CC1O
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| InChI |
InChI=1S/C20H17N5O3/c1-11-5-6-12(18-23-20(28-24-18)13-9-16(13)26)8-14(11)22-19(27)15-10-21-17-4-2-3-7-25(15)17/h2-8,10,13,16,26H,9H2,1H3,(H,22,27)
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| InChIKey |
VVYKXEVSEJUERS-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