General Information of the Compound
| Compound ID |
CP0554325
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| Compound Name |
(2R)-N-(3-{2,3-dihydrospiro[indene-1,4'-piperidine]-1'-yl}propyl)-2-hydroxy-3-phenylpropanamide
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| Structure |
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| Formula |
C29H32N2O2
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| Molecular Weight |
440.587
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| Canonical SMILES |
O=C(NCCCN1CCC2(CCc3ccccc23)CC1)c1cccc(Oc2ccccc2)c1
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| InChI |
InChI=1S/C29H32N2O2/c32-28(24-9-6-12-26(22-24)33-25-10-2-1-3-11-25)30-18-7-19-31-20-16-29(17-21-31)15-14-23-8-4-5-13-27(23)29/h1-6,8-13,22H,7,14-21H2,(H,30,32)
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| InChIKey |
KSNLIWRBJFSDFJ-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