General Information of the Compound
| Compound ID |
CP0450235
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| Compound Name |
N-[(1S,3S)-3-(pyridine-2-carbonylamino)cyclohexyl]pyridine-2-carboxamide
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| Structure |
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| Formula |
C18H20N4O2
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| Molecular Weight |
324.384
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| Canonical SMILES |
O=C(N[C@H]1CCC[C@@H](C1)NC(=O)c1ccccn1)c1ccccn1
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| InChI |
InChI=1S/C18H20N4O2/c23-17(15-8-1-3-10-19-15)21-13-6-5-7-14(12-13)22-18(24)16-9-2-4-11-20-16/h1-4,8-11,13-14H,5-7,12H2,(H,21,23)(H,22,24)/t13-,14-/m0/s1
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| InChIKey |
RCTCXCNGQBTQMS-KBPBESRZSA-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