General Information of the Compound
| Compound ID |
CP0248247
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| Compound Name |
N-[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]naphthalene-1-sulfonamide
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| Structure |
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| Formula |
C17H17N3O3S
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| Molecular Weight |
343.408
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| Canonical SMILES |
O=C(CNS(=O)(=O)c1cccc2ccccc12)N1CCC[C@H]1C#N
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| InChI |
InChI=1S/C17H17N3O3S/c18-11-14-7-4-10-20(14)17(21)12-19-24(22,23)16-9-3-6-13-5-1-2-8-15(13)16/h1-3,5-6,8-9,14,19H,4,7,10,12H2/t14-/m0/s1
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| InChIKey |
HRIKQHHODIYSSE-AWEZNQCLSA-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