General Information of the Compound
| Compound ID |
CP0035162
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| Compound Name |
N-[(1R,2S)-2-phenylcyclopropyl]-4-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide
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| Structure |
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| Formula |
C22H23N5O2
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| Molecular Weight |
389.459
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| Canonical SMILES |
O=C(N[C@@H]1C[C@H]1c1ccccc1)N1CCC(CC1)c1nc(no1)-c1ccccn1
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| InChI |
InChI=1S/C22H23N5O2/c28-22(24-19-14-17(19)15-6-2-1-3-7-15)27-12-9-16(10-13-27)21-25-20(26-29-21)18-8-4-5-11-23-18/h1-8,11,16-17,19H,9-10,12-14H2,(H,24,28)/t17-,19+/m0/s1
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| InChIKey |
IIPPFWIHUHXQNA-PKOBYXMFSA-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