General Information of the Compound
| Compound ID |
CP0386940
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| Compound Name |
(R)-2-(3-(2-(2-hydroxy-2-(4-hydroxy-3-(methylsulfonamido)phenyl)ethylamino)-2-methylpropyl)phenyl)-N-((6-hydroxynaphthalen-2-yl)methyl)acetamide
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| Structure |
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| Formula |
C32H37N3O6S
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| Molecular Weight |
591.73
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| Canonical SMILES |
CC(C)(Cc1cccc(CC(=O)NCc2ccc3cc(O)ccc3c2)c1)NC[C@H](O)c1ccc(O)c(NS(C)(=O)=O)c1
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| InChI |
InChI=1S/C32H37N3O6S/c1-32(2,34-20-30(38)26-10-12-29(37)28(17-26)35-42(3,40)41)18-22-6-4-5-21(13-22)15-31(39)33-19-23-7-8-25-16-27(36)11-9-24(25)14-23/h4-14,16-17,30,34-38H,15,18-20H2,1-3H3,(H,33,39)/t30-/m0/s1
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| InChIKey |
FJTDUQZQFNOEFI-PMERELPUSA-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