General Information of the Compound
| Compound ID |
CP0491913
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| Compound Name |
2-cyclohexyl-N-(3-{2,3-dihydrospiro[indene-1,4'-piperidine]-1'-yl}propyl)-2-hydroxy-2-phenylacetamide
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| Structure |
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| Formula |
C30H40N2O2
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| Molecular Weight |
460.662
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| Canonical SMILES |
OC(C1CCCCC1)(C(=O)NCCCN1CCC2(CCc3ccccc23)CC1)c1ccccc1
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| InChI |
InChI=1S/C30H40N2O2/c33-28(30(34,25-11-3-1-4-12-25)26-13-5-2-6-14-26)31-20-9-21-32-22-18-29(19-23-32)17-16-24-10-7-8-15-27(24)29/h1,3-4,7-8,10-12,15,26,34H,2,5-6,9,13-14,16-23H2,(H,31,33)
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| InChIKey |
RLXLAVLKBFSJQT-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