General Information of the Compound
| Compound ID |
CP0466875
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| Compound Name |
US9067871, 11
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| Structure |
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| Formula |
C23H30Cl2N2O3S
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| Molecular Weight |
485.477
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| Canonical SMILES |
CCCS(=O)(=O)N(C)CCOc1ccc2CCC(N)C(Cc3ccc(Cl)c(Cl)c3)c2c1
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| InChI |
InChI=1S/C23H30Cl2N2O3S/c1-3-12-31(28,29)27(2)10-11-30-18-7-5-17-6-9-23(26)20(19(17)15-18)13-16-4-8-21(24)22(25)14-16/h4-5,7-8,14-15,20,23H,3,6,9-13,26H2,1-2H3
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| InChIKey |
JEDFHGGTTPYXTM-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