(Z)-3-[3-(furan-2-yl)-1-phenylpyrazol-4-yl]-1-thiophen-2-ylprop-2-en-1-one

Formula:C20H14N2O2S Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-3-[3-(furan-2-yl)-1-phenylpyrazol-4-yl]-1-thiophen-2-ylprop-2-en-1-one is a drug-like molecule.

MolName	(Z)-3-[3-(furan-2-yl)-1-phenylpyrazol-4-yl]-1-thiophen-2-ylprop-2-en-1-one
MolecularFormula	C20H14N2O2S
Smiles	O=C(/C=C\c1cn(-c2ccccc2)nc1-c1ccco1)c1cccs1
InChI	InChI=1S/C20H14N2O2S/c23-17(19-9-5-13-25-19)11-10-15-14-22(16-6-2-1-3-7-16)21-20(15)18-8-4-12-24-18/h1-14H
InChIK	OTZQAQUEXNTPOP-UHFFFAOYSA-N
TotalMolweight	346.409
Molweight	346.409
MonoisotopicMass	346.077598
CLogP	3.3151
CLogS	-4.713
H Acceptors	4
TotalSurfaceArea	270.38
Relative PSA	0.2417
PolarSurfaceArea	76.27
Druglikeness	4.8494
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.52
Fragments	1
Non HAtoms	25
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Symmetricatoms	2
Aromatic Nitrogens	2
StereoCon

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