General Information of the Compound
| Compound ID |
CP0495783
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| Compound Name |
8-Methoxy-2-oxo-1,2,5,6-tetrahydro-4H-pyrrolo[3,2,1-ij]quinoline-1-carboxylic acid benzothiazol-2-ylamide
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| Structure |
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| Formula |
C20H17N3O3S
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| Molecular Weight |
379.441
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| Canonical SMILES |
COc1cc2C(C(=O)Nc3nc4ccccc4s3)C(=O)N3CCCc(c1)c23
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| InChI |
InChI=1S/C20H17N3O3S/c1-26-12-9-11-5-4-8-23-17(11)13(10-12)16(19(23)25)18(24)22-20-21-14-6-2-3-7-15(14)27-20/h2-3,6-7,9-10,16H,4-5,8H2,1H3,(H,21,22,24)
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| InChIKey |
GOJJFFXBKVYEOR-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