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EHH

Summary
Name:[3,5-dimethyl-4-(1-methyl-5-pyridin-4-yl-imidazol-4-yl)phenyl]methanamine
Formula:C18 H20 N4
Formal charge:0
Formula weight:292.378 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.6[3,5-dimethyl-4-(1-methyl-5-pyridin-4-yl-imidazol-4-yl)phenyl]methanamine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C18H20N4/c1-12-8-14(10-19)9-13(2)16(12)17-18(22(3)11-21-17)15-4-6-20-7-5-15/h4-9,11H,10,19H2,1-3H3
InChIKeyInChI1.03LYFZPAXTPPYSEC-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Cn1cnc(c1c2ccncc2)c3c(C)cc(CN)cc3C
SMILESCACTVS3.385Cn1cnc(c1c2ccncc2)c3c(C)cc(CN)cc3C
SMILES_CANONICALOpenEye OEToolkits2.0.6Cc1cc(cc(c1c2c(n(cn2)C)c3ccncc3)C)CN
SMILESOpenEye OEToolkits2.0.6Cc1cc(cc(c1c2c(n(cn2)C)c3ccncc3)C)CN

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PDB entries from 2024-07-17

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