2-[(E)-2-[3-(3-chlorophenyl)-1-phenylpyrazol-4-yl]ethenyl]-4-(4-fluorophenyl)-1,3-thiazole

Formula:C26H17N3ClFS Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(E)-2-[3-(3-chlorophenyl)-1-phenylpyrazol-4-yl]ethenyl]-4-(4-fluorophenyl)-1,3-thiazole is not a drug-like molecule.

MolName	2-[(E)-2-[3-(3-chlorophenyl)-1-phenylpyrazol-4-yl]ethenyl]-4-(4-fluorophenyl)-1,3-thiazole
MolecularFormula	C26H17N3ClFS
Smiles	Fc(cc1)ccc1-c1csc(/C=C/c2cn(-c3ccccc3)nc2-c2cccc(Cl)c2)n1
InChI	InChI=1S/C26H17ClFN3S/c27-21-6-4-5-19(15-21)26-20(16-31(30-26)23-7-2-1-3-8-23)11-14-25-29-24(17-32-25)18-9-12-22(28)13-10-18/h1-17H
InChIK	KXFYEWKGLPAZDF-UHFFFAOYSA-N
TotalMolweight	457.959
Molweight	457.959
MonoisotopicMass	457.081572
CLogP	6.0727
CLogS	-7.123
H Acceptors	3
TotalSurfaceArea	343.23
Relative PSA	0.14326
PolarSurfaceArea	58.95
Druglikeness	3.5556
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.53125
Fragments	1
Non HAtoms	32
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	28
Symmetricatoms	4
Aromatic Nitrogens	3
StereoCon

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1 - 2-[(E)-2-[3-(3-chlorophenyl)-1-phenylpyrazol-4-yl]ethenyl]-4-(4-fluorophenyl)-1,3-thiazole | 2 - 2-[(E)-2-[3-(3-chlorophenyl)-1-phenylpyrazol-4-yl]ethenyl]-4-(4-fluorophenyl)-1,3-thiazole

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