General Information of the Compound
| Compound ID |
CP0372149
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| Compound Name |
N-[(2R)-3-(2-ethylpiperidin-1-yl)-2-hydroxypropyl]naphthalene-1-sulfonamide
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| Structure |
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| Formula |
C20H28N2O3S
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| Molecular Weight |
376.522
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| Canonical SMILES |
CCC1CCCCN1C[C@@H](O)CNS(=O)(=O)c1cccc2ccccc12
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| InChI |
InChI=1S/C20H28N2O3S/c1-2-17-10-5-6-13-22(17)15-18(23)14-21-26(24,25)20-12-7-9-16-8-3-4-11-19(16)20/h3-4,7-9,11-12,17-18,21,23H,2,5-6,10,13-15H2,1H3/t17?,18-/m0/s1
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| InChIKey |
KMHBKDJSYQLVTR-ZVAWYAOSSA-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