General Information of the Compound
| Compound ID |
CP0434185
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| Compound Name |
(S)-N-(1-(2-amino-3,3-diphenylpropanoyl)piperidin-4-yl)-N-phenylpropionamide
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| Structure |
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| Formula |
C29H33N3O2
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| Molecular Weight |
455.602
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| Canonical SMILES |
CCC(=O)N(C1CCN(CC1)C(=O)[C@@H](N)C(c1ccccc1)c1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C29H33N3O2/c1-2-26(33)32(24-16-10-5-11-17-24)25-18-20-31(21-19-25)29(34)28(30)27(22-12-6-3-7-13-22)23-14-8-4-9-15-23/h3-17,25,27-28H,2,18-21,30H2,1H3/t28-/m0/s1
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| InChIKey |
GWGNHAAYLSFCPG-NDEPHWFRSA-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
Protein ID: PT01200, Delta-type opioid receptor
Protein ID: PT01549, Mu-type opioid receptor