General Information of the Compound
| Compound ID |
CP0662149
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| Compound Name |
SID864653
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| Structure |
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| Formula |
C19H19N3O4S
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| Molecular Weight |
385.445
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| Canonical SMILES |
CN(C)c1ccc(C2=NOC(CN3C(=O)c4ccccc4S3(=O)=O)C2)cc1
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| InChI |
InChI=1S/C19H19N3O4S/c1-21(2)14-9-7-13(8-10-14)17-11-15(26-20-17)12-22-19(23)16-5-3-4-6-18(16)27(22,24)25/h3-10,15H,11-12H2,1-2H3
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| InChIKey |
MKWLRSLXLQYTGJ-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