General Information of the Compound
| Compound ID |
CP0473518
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| Compound Name |
N-[(1S,3S)-3-[(3-chlorobenzoyl)amino]cyclohexyl]-4-methylpyridine-2-carboxamide
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| Structure |
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| Formula |
C20H22ClN3O2
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| Molecular Weight |
371.868
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| Canonical SMILES |
Cc1ccnc(c1)C(=O)N[C@H]1CCC[C@@H](C1)NC(=O)c1cccc(Cl)c1
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| InChI |
InChI=1S/C20H22ClN3O2/c1-13-8-9-22-18(10-13)20(26)24-17-7-3-6-16(12-17)23-19(25)14-4-2-5-15(21)11-14/h2,4-5,8-11,16-17H,3,6-7,12H2,1H3,(H,23,25)(H,24,26)/t16-,17-/m0/s1
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| InChIKey |
ALDADKORIIAEHP-IRXDYDNUSA-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