General Information of the Compound
| Compound ID |
CP0478315
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| Compound Name |
cyclohexyl-[(3S,4S)-3-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyrrolidin-1-yl]methanone
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| Structure |
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| Formula |
C29H38N2O
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| Molecular Weight |
430.636
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| Canonical SMILES |
O=C(C1CCCCC1)N1C[C@H](CN2CCC(CC2)c2ccccc2)[C@H](C1)c1ccccc1
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| InChI |
InChI=1S/C29H38N2O/c32-29(26-14-8-3-9-15-26)31-21-27(28(22-31)25-12-6-2-7-13-25)20-30-18-16-24(17-19-30)23-10-4-1-5-11-23/h1-2,4-7,10-13,24,26-28H,3,8-9,14-22H2/t27-,28+/m0/s1
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| InChIKey |
PJJLWEODISMAPG-WUFINQPMSA-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