General Information of the Compound
| Compound ID |
CP0514308
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| Compound Name |
3-Benzyl-piperidine-1-carboxylic acid adamantan-2-ylamide
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| Structure |
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| Formula |
C23H32N2O
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| Molecular Weight |
352.522
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| Canonical SMILES |
O=C(NC1C2CC3CC(C2)CC1C3)N1CCCC(Cc2ccccc2)C1
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| InChI |
InChI=1S/C23H32N2O/c26-23(24-22-20-11-18-10-19(13-20)14-21(22)12-18)25-8-4-7-17(15-25)9-16-5-2-1-3-6-16/h1-3,5-6,17-22H,4,7-15H2,(H,24,26)
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| InChIKey |
MURFOEYIMQOXKM-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