General Information of the Compound
| Compound ID |
CP0480751
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| Compound Name |
US8912224, 317
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| Structure |
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| Formula |
C23H24N2O3S
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| Molecular Weight |
408.523
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| Canonical SMILES |
CCCCNC(=O)c1cnc(Oc2ccc3OC(CCc3c2)c2ccccc2)s1
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| InChI |
InChI=1S/C23H24N2O3S/c1-2-3-13-24-22(26)21-15-25-23(29-21)27-18-10-12-20-17(14-18)9-11-19(28-20)16-7-5-4-6-8-16/h4-8,10,12,14-15,19H,2-3,9,11,13H2,1H3,(H,24,26)
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| InChIKey |
KQNFPNUSCNVXMO-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