General Information of the Compound
| Compound ID |
CP0465546
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| Compound Name |
US8680275, 19
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| Structure |
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| Formula |
C24H26N4O2S
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| Molecular Weight |
434.565
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| Canonical SMILES |
Cc1ccc(C)c(c1)S(=O)(=O)N1CCC2CN(C2C1)c1nccc(n1)-c1ccccc1
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| InChI |
InChI=1S/C24H26N4O2S/c1-17-8-9-18(2)23(14-17)31(29,30)27-13-11-20-15-28(22(20)16-27)24-25-12-10-21(26-24)19-6-4-3-5-7-19/h3-10,12,14,20,22H,11,13,15-16H2,1-2H3
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| InChIKey |
JCYBCKCBKJIKFC-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