N-[(Z)-3-(furan-2-ylmethylamino)-3-oxo-1-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-1-en-2-yl]benzamide

Formula:C28H22N4O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-3-(furan-2-ylmethylamino)-3-oxo-1-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-1-en-2-yl]benzamide is a drug-like molecule.

MolName	N-[(Z)-3-(furan-2-ylmethylamino)-3-oxo-1-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-1-en-2-yl]benzamide
MolecularFormula	C28H22N4O3S
Smiles	O=C(/C(/NC(c1ccccc1)=O)=C/c1cn(-c2ccccc2)nc1-c1cccs1)NCc1ccco1
InChI	InChI=1S/C28H22N4O3S/c33-27(20-9-3-1-4-10-20)30-24(28(34)29-18-23-13-7-15-35-23)17-21-19-32(22-11-5-2-6-12-22)31-26(21)25-14-8-16-36-25/h1-17,19H,18H2,(H,29,34)(H,30,33)
InChIK	GPUXGFYWICNSEG-UHFFFAOYSA-N
TotalMolweight	494.574
Molweight	494.574
MonoisotopicMass	494.141261
CLogP	4.2644
CLogS	-5.805
H Acceptors	7
H Donors	2
TotalSurfaceArea	382.78
Relative PSA	0.26467
PolarSurfaceArea	117.4
Druglikeness	6.5924
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.41667
Fragments	1
Non HAtoms	36
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	8
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	27
Sp3Atoms	1
Symmetricatoms	4
Amides	2
Aromatic Nitrogens	2
StereoCon

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