General Information of the Compound
| Compound ID |
CP0243638
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| Compound Name |
US9340555, 74
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| Structure |
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| Formula |
C24H23N3O4S
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| Molecular Weight |
449.532
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| Canonical SMILES |
CCN(CC)C(=O)c1cc2nccc(Oc3cccc(NC(=O)c4occc4C)c3)c2s1
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| InChI |
InChI=1S/C24H23N3O4S/c1-4-27(5-2)24(29)20-14-18-22(32-20)19(9-11-25-18)31-17-8-6-7-16(13-17)26-23(28)21-15(3)10-12-30-21/h6-14H,4-5H2,1-3H3,(H,26,28)
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| InChIKey |
DSQRVMBFBBVGRP-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