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LV1

Summary
Name:1-(4-fluorophenyl)-3-(3-hydroxyphenyl)urea
Formula:C13 H11 F N2 O2
Formal charge:0
Formula weight:246.237 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.61-(4-fluorophenyl)-3-(3-hydroxyphenyl)urea

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C13H11FN2O2/c14-9-4-6-10(7-5-9)15-13(18)16-11-2-1-3-12(17)8-11/h1-8,17H,(H2,15,16,18)
InChIKeyInChI1.03BASVXNNPMBRKEP-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Oc1cccc(NC(=O)Nc2ccc(F)cc2)c1
SMILESCACTVS3.385Oc1cccc(NC(=O)Nc2ccc(F)cc2)c1
SMILES_CANONICALOpenEye OEToolkits2.0.6c1cc(cc(c1)O)NC(=O)Nc2ccc(cc2)F
SMILESOpenEye OEToolkits2.0.6c1cc(cc(c1)O)NC(=O)Nc2ccc(cc2)F

218853

PDB entries from 2024-04-24

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