General Information of the Compound
| Compound ID |
CP0141347
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| Compound Name |
4-chloro-3-[1-(2-chloro-6-fluorobenzoyl)-3,4-dihydro-2H-quinolin-6-yl]-N-cyclopentylbenzamide
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| Structure |
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| Formula |
C28H25Cl2FN2O2
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| Molecular Weight |
511.424
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| Canonical SMILES |
Fc1cccc(Cl)c1C(=O)N1CCCc2cc(ccc12)-c1cc(ccc1Cl)C(=O)NC1CCCC1
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| InChI |
InChI=1S/C28H25Cl2FN2O2/c29-22-12-10-19(27(34)32-20-6-1-2-7-20)16-21(22)17-11-13-25-18(15-17)5-4-14-33(25)28(35)26-23(30)8-3-9-24(26)31/h3,8-13,15-16,20H,1-2,4-7,14H2,(H,32,34)
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| InChIKey |
MDIPXKVAIMQBBC-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