General Information of the Compound
| Compound ID |
CP0565508
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| Compound Name |
1-(2-Bromo-phenyl)-3-(4-cyano-2-hydroxy-phenyl)-urea
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| Synonyms |
1-(2-bromophenyl)-3-(4-cyano-2-hydroxyphenyl)urea
BDBM50140796
CHEMBL27863
SCHEMBL3705632
ZINC13559608
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| Structure |
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| Formula |
C14H10BrN3O2
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| Molecular Weight |
332.157
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| Canonical SMILES |
Oc1cc(ccc1NC(=O)Nc1ccccc1Br)C#N
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| InChI |
InChI=1S/C14H10BrN3O2/c15-10-3-1-2-4-11(10)17-14(20)18-12-6-5-9(8-16)7-13(12)19/h1-7,19H,(H2,17,18,20)
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| InChIKey |
VIKJECVSALYBJB-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
Clinical Information about the Compound