General Information of the Compound
| Compound ID |
CP0484815
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| Compound Name |
US8969325, 220
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| Structure |
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| Formula |
C19H19N3O3
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| Molecular Weight |
337.379
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| Canonical SMILES |
O=C(N[C@@H]1CCOc2ccccc12)Nc1ccc2CCC(=O)Nc2c1
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| InChI |
InChI=1S/C19H19N3O3/c23-18-8-6-12-5-7-13(11-16(12)21-18)20-19(24)22-15-9-10-25-17-4-2-1-3-14(15)17/h1-5,7,11,15H,6,8-10H2,(H,21,23)(H2,20,22,24)/t15-/m1/s1
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| InChIKey |
SJMOXQGCUFHJIH-OAHLLOKOSA-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