General Information of the Compound
| Compound ID |
CP0382138
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| Compound Name |
N-[(2R)-3-(2,4-dimethylpyrrolidin-1-yl)-2-hydroxypropyl]naphthalene-2-sulfonamide
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| Structure |
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| Formula |
C19H26N2O3S
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| Molecular Weight |
362.495
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| Canonical SMILES |
CC1CC(C)N(C[C@@H](O)CNS(=O)(=O)c2ccc3ccccc3c2)C1
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| InChI |
InChI=1S/C19H26N2O3S/c1-14-9-15(2)21(12-14)13-18(22)11-20-25(23,24)19-8-7-16-5-3-4-6-17(16)10-19/h3-8,10,14-15,18,20,22H,9,11-13H2,1-2H3/t14?,15?,18-/m0/s1
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| InChIKey |
XTEIDNBHYNANFK-JMLCCBQJSA-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