General Information of the Compound
| Compound ID |
CP0160303
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| Compound Name |
(S)-1-(4-(2-(2-fluoroethoxy)ethoxy)benzyl)-5-(2-(phenoxymethyl)pyrrolidin-1-ylsulfonyl)indoline-2,3-dione
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| Structure |
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| Formula |
C30H31FN2O7S
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| Molecular Weight |
582.65
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| Canonical SMILES |
FCCOCCOc1ccc(CN2C(=O)C(=O)c3cc(ccc23)S(=O)(=O)N2CCC[C@H]2COc2ccccc2)cc1
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| InChI |
InChI=1S/C30H31FN2O7S/c31-14-16-38-17-18-39-25-10-8-22(9-11-25)20-32-28-13-12-26(19-27(28)29(34)30(32)35)41(36,37)33-15-4-5-23(33)21-40-24-6-2-1-3-7-24/h1-3,6-13,19,23H,4-5,14-18,20-21H2/t23-/m0/s1
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| InChIKey |
SVBRVLOFXVNEPG-QHCPKHFHSA-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