(Z)-3-(1,3-diphenylpyrazol-4-yl)-1-(4-fluorophenyl)prop-2-en-1-one

Formula:C24H17N2OF Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-3-(1,3-diphenylpyrazol-4-yl)-1-(4-fluorophenyl)prop-2-en-1-one is a drug-like molecule.

MolName(Z)-3-(1,3-diphenylpyrazol-4-yl)-1-(4-fluorophenyl)prop-2-en-1-one
MolecularFormulaC24H17N2OF
SmilesO=C(/C=C\c1cn(-c2ccccc2)nc1-c1ccccc1)c(cc1)ccc1F
InChIInChI=1S/C24H17FN2O/c25-21-14-11-18(12-15-21)23(28)16-13-20-17-27(22-9-5-2-6-10-22)26-24(20)19-7-3-1-4-8-19/h1-17H
InChIKSMCSEQLZYBVMTH-UHFFFAOYSA-N
TotalMolweight368.41
Molweight368.41
MonoisotopicMass368.132491
CLogP4.3236
CLogS-5.667
H Acceptors3
TotalSurfaceArea291.1
Relative PSA0.10608
PolarSurfaceArea34.89
Druglikeness2.0323
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.53571
Fragments1
Non HAtoms28
NonCHAtoms4
Electronegative Atoms4
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms23
Symmetricatoms6
Aromatic Nitrogens2
StereoCon

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