General Information of the Compound
| Compound ID |
CP0909795
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| Compound Name |
SID85810294
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| Structure |
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| Formula |
C30H36FN3O7S2
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| Molecular Weight |
633.764
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| Canonical SMILES |
Cc1ccc(S(=O)(=O)N(C)C[C@H]2Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3CC(=O)N([C@H](C)CO)C[C@H]2C)cc1
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| InChI |
InChI=1S/C30H36FN3O7S2/c1-20-5-10-27(11-6-20)43(39,40)33(4)18-29-21(2)17-34(22(3)19-35)30(36)16-23-15-25(9-14-28(23)41-29)32-42(37,38)26-12-7-24(31)8-13-26/h5-15,21-22,29,32,35H,16-19H2,1-4H3/t21-,22-,29-/m1/s1
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| InChIKey |
VJLRAPUULLUHLH-IEOSBIPESA-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