General Information of the Compound
| Compound ID |
CP0416768
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| Compound Name |
N-[3-[(7-chloroquinolin-4-yl)amino]-5-(morpholin-4-ylmethyl)phenyl]-2-piperidin-1-ylacetamide
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| Structure |
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| Formula |
C27H32ClN5O2
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| Molecular Weight |
494.039
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| Canonical SMILES |
Clc1ccc2c(Nc3cc(CN4CCOCC4)cc(NC(=O)CN4CCCCC4)c3)ccnc2c1
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| InChI |
InChI=1S/C27H32ClN5O2/c28-21-4-5-24-25(6-7-29-26(24)16-21)30-22-14-20(18-33-10-12-35-13-11-33)15-23(17-22)31-27(34)19-32-8-2-1-3-9-32/h4-7,14-17H,1-3,8-13,18-19H2,(H,29,30)(H,31,34)
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| InChIKey |
UENVABGRVVRAKS-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