General Information of the Compound
| Compound ID |
CP0646631
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| Compound Name |
SID14732208
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| Structure |
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| Formula |
C24H27N3O5S
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| Molecular Weight |
469.563
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| Canonical SMILES |
Cn1c(=O)oc2cc(S(=O)(=O)N3CCCC(C(=O)NC4CCCc5ccccc54)C3)ccc21
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| InChI |
InChI=1S/C24H27N3O5S/c1-26-21-12-11-18(14-22(21)32-24(26)29)33(30,31)27-13-5-8-17(15-27)23(28)25-20-10-4-7-16-6-2-3-9-19(16)20/h2-3,6,9,11-12,14,17,20H,4-5,7-8,10,13,15H2,1H3,(H,25,28)
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| InChIKey |
DKMABXCXWSMXRS-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