General Information of the Compound
| Compound ID |
CP0014413
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| Compound Name |
US10307413, Compound 31
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| Structure |
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| Formula |
C20H25N3O4S
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| Molecular Weight |
403.504
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| Canonical SMILES |
CS(=O)(=O)Nc1ccc(cc1)C(=O)NCC(O)CN1CCc2ccccc2C1
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| InChI |
InChI=1S/C20H25N3O4S/c1-28(26,27)22-18-8-6-16(7-9-18)20(25)21-12-19(24)14-23-11-10-15-4-2-3-5-17(15)13-23/h2-9,19,22,24H,10-14H2,1H3,(H,21,25)
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| InChIKey |
YTWFJGHYCYWUIX-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