General Information of the Compound
| Compound ID |
CP0427766
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| Compound Name |
1-Oxo-1,2-dihydro-6-oxa-10b-aza-aceanthrylene-2-carboxylic acid thiazol-2-ylamide
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| Structure |
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| Formula |
C18H11N3O3S
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| Molecular Weight |
349.371
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| Canonical SMILES |
O=C(Nc1nccs1)C1C(=O)N2c3c1cccc3Oc1ccccc21
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| InChI |
InChI=1S/C18H11N3O3S/c22-16(20-18-19-8-9-25-18)14-10-4-3-7-13-15(10)21(17(14)23)11-5-1-2-6-12(11)24-13/h1-9,14H,(H,19,20,22)
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| InChIKey |
CVSIFFANCIQNKO-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