General Information of the Compound
| Compound ID |
CP0510038
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| Compound Name |
(S)-N-(1-benzylpiperidin-4-yl)-N-methyl-1-(naphthalen-1-ylsulfonyl)pyrrolidine-2-carboxamide
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| Structure |
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| Formula |
C28H33N3O3S
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| Molecular Weight |
491.657
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| Canonical SMILES |
CN(C1CCN(Cc2ccccc2)CC1)C(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc2ccccc12
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| InChI |
InChI=1S/C28H33N3O3S/c1-29(24-16-19-30(20-17-24)21-22-9-3-2-4-10-22)28(32)26-14-8-18-31(26)35(33,34)27-15-7-12-23-11-5-6-13-25(23)27/h2-7,9-13,15,24,26H,8,14,16-21H2,1H3/t26-/m0/s1
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| InChIKey |
UERQBVCBQVYGOF-SANMLTNESA-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