General Information of the Compound
| Compound ID |
CP0486947
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| Compound Name |
N-[(1S,2S)-2-(3-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropylcarbamoyl)cyclohexyl]benzamide
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| Structure |
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| Formula |
C30H39N3O2
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| Molecular Weight |
473.661
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| Canonical SMILES |
O=C(NCCCN1CCC2(CCc3ccccc23)CC1)[C@H]1CCCC[C@@H]1NC(=O)c1ccccc1
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| InChI |
InChI=1S/C30H39N3O2/c34-28(24-10-2-1-3-11-24)32-27-14-7-5-12-25(27)29(35)31-19-8-20-33-21-17-30(18-22-33)16-15-23-9-4-6-13-26(23)30/h1-4,6,9-11,13,25,27H,5,7-8,12,14-22H2,(H,31,35)(H,32,34)/t25-,27-/m0/s1
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| InChIKey |
UUJCILFUAUVCOT-BDYUSTAISA-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