N-[(Z)-3-(benzylamino)-1-(4-chlorophenyl)sulfanyl-3-oxo-1-phenylprop-1-en-2-yl]benzamide

Formula:C29H23N2O2ClS Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-3-(benzylamino)-1-(4-chlorophenyl)sulfanyl-3-oxo-1-phenylprop-1-en-2-yl]benzamide is not a drug-like molecule.

MolName	N-[(Z)-3-(benzylamino)-1-(4-chlorophenyl)sulfanyl-3-oxo-1-phenylprop-1-en-2-yl]benzamide
MolecularFormula	C29H23N2O2ClS
Smiles	O=C(/C(/NC(c1ccccc1)=O)=C(\c1ccccc1)/Sc(cc1)ccc1Cl)NCc1ccccc1
InChI	InChI=1S/C29H23ClN2O2S/c30-24-16-18-25(19-17-24)35-27(22-12-6-2-7-13-22)26(32-28(33)23-14-8-3-9-15-23)29(34)31-20-21-10-4-1-5-11-21/h1-19H,20H2,(H,31,34)(H,32,33)
InChIK	WUKYVZJMVTXRRI-UHFFFAOYSA-N
TotalMolweight	499.033
Molweight	499.033
MonoisotopicMass	498.116875
CLogP	6.4452
CLogS	-5.885
H Acceptors	4
H Donors	2
TotalSurfaceArea	380.55
Relative PSA	0.17472
PolarSurfaceArea	83.5
Druglikeness	4.2563
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.42857
Fragments	1
Non HAtoms	35
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	8
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	24
Sp3Atoms	2
Symmetricatoms	8
Amides	2
StereoCon

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