General Information of the Compound
| Compound ID |
CP0260500
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| Compound Name |
N-(4-ethylphenyl)-N-(2-methylpropyl)-4-(oxan-4-ylmethoxy)-5-oxo-7,8-dihydro-6H-naphthalene-1-sulfonamide
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| Structure |
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| Formula |
C28H37NO5S
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| Molecular Weight |
499.673
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| Canonical SMILES |
CCc1ccc(cc1)N(CC(C)C)S(=O)(=O)c1ccc(OCC2CCOCC2)c2C(=O)CCCc12
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| InChI |
InChI=1S/C28H37NO5S/c1-4-21-8-10-23(11-9-21)29(18-20(2)3)35(31,32)27-13-12-26(28-24(27)6-5-7-25(28)30)34-19-22-14-16-33-17-15-22/h8-13,20,22H,4-7,14-19H2,1-3H3
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| InChIKey |
GCVLDVYPRKMGNN-UHFFFAOYSA-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