General Information of the Compound
| Compound ID |
CP0412148
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| Compound Name |
US9169224, 157
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| Structure |
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| Formula |
C18H19Cl2N3O
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| Molecular Weight |
364.276
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| Canonical SMILES |
Clc1ccc(CN2CCN(CC2)C(=O)Nc2ccccc2)cc1Cl
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| InChI |
InChI=1S/C18H19Cl2N3O/c19-16-7-6-14(12-17(16)20)13-22-8-10-23(11-9-22)18(24)21-15-4-2-1-3-5-15/h1-7,12H,8-11,13H2,(H,21,24)
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| InChIKey |
QLRZJFNUVYGKQQ-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