(E)-3-[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]-1-(4-fluorophenyl)prop-2-en-1-one

Formula:C24H16N2OClF Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]-1-(4-fluorophenyl)prop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]-1-(4-fluorophenyl)prop-2-en-1-one
MolecularFormula	C24H16N2OClF
Smiles	O=C(/C=C/c1cn(-c2ccccc2)nc1-c(cc1)ccc1Cl)c(cc1)ccc1F
InChI	InChI=1S/C24H16ClFN2O/c25-20-11-6-18(7-12-20)24-19(16-28(27-24)22-4-2-1-3-5-22)10-15-23(29)17-8-13-21(26)14-9-17/h1-16H
InChIK	IDEHXWIGBOCAGV-UHFFFAOYSA-N
TotalMolweight	402.855
Molweight	402.855
MonoisotopicMass	402.093518
CLogP	4.9296
CLogS	-6.403
H Acceptors	3
TotalSurfaceArea	306.52
Relative PSA	0.10074
PolarSurfaceArea	34.89
Druglikeness	2.0725
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.51724
Fragments	1
Non HAtoms	29
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	23
Symmetricatoms	6
Aromatic Nitrogens	2
StereoCon

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