General Information of the Compound
| Compound ID |
CP0503171
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| Compound Name |
4-Phenyl-1-((3R,4S)-4-phenyl-pyrrolidin-3-ylmethyl)-piperidine
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| Structure |
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| Formula |
C22H28N2
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| Molecular Weight |
320.48
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| Canonical SMILES |
C([C@H]1CNC[C@@H]1c1ccccc1)N1CCC(CC1)c1ccccc1
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| InChI |
InChI=1S/C22H28N2/c1-3-7-18(8-4-1)19-11-13-24(14-12-19)17-21-15-23-16-22(21)20-9-5-2-6-10-20/h1-10,19,21-23H,11-17H2/t21-,22-/m1/s1
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| InChIKey |
ZIJSVPUNZCZGCP-FGZHOGPDSA-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