General Information of the Compound
| Compound ID |
CP0510561
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| Compound Name |
N-[[5-chloro-4-[[2-methyl-4-(2-methylpyrazol-3-yl)quinolin-8-yl]oxymethyl]pyridin-3-yl]methyl]-2-methylpropanamide
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| Structure |
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| Formula |
C25H26ClN5O2
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| Molecular Weight |
463.969
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| Canonical SMILES |
CC(C)C(=O)NCc1cncc(Cl)c1COc1cccc2c(cc(C)nc12)-c1ccnn1C
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| InChI |
InChI=1S/C25H26ClN5O2/c1-15(2)25(32)28-12-17-11-27-13-21(26)20(17)14-33-23-7-5-6-18-19(10-16(3)30-24(18)23)22-8-9-29-31(22)4/h5-11,13,15H,12,14H2,1-4H3,(H,28,32)
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| InChIKey |
GCLIIFCMFQJTIG-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