3,5-dibenzamido-N-[4-[(E)-3-oxo-3-thiophen-2-ylprop-1-enyl]phenyl]benzamide

Formula:C34H25N3O4S Mutagenic:high Tumorigenic:high Reproductive Effective:none 3,5-dibenzamido-N-[4-[(E)-3-oxo-3-thiophen-2-ylprop-1-enyl]phenyl]benzamide is not a drug-like molecule.

MolName	3,5-dibenzamido-N-[4-[(E)-3-oxo-3-thiophen-2-ylprop-1-enyl]phenyl]benzamide
MolecularFormula	C34H25N3O4S
Smiles	O=C(/C=C/c(cc1)ccc1NC(c1cc(NC(c2ccccc2)=O)cc(NC(c2ccccc2)=O)c1)=O)c1cccs1
InChI	InChI=1S/C34H25N3O4S/c38-30(31-12-7-19-42-31)18-15-23-13-16-27(17-14-23)35-34(41)26-20-28(36-32(39)24-8-3-1-4-9-24)22-29(21-26)37-33(40)25-10-5-2-6-11-25/h1-22H,(H,35,41)(H,36,39)(H,37,40)
InChIK	AMBGQUYVMPOJQO-UHFFFAOYSA-N
TotalMolweight	571.656
Molweight	571.656
MonoisotopicMass	571.156577
CLogP	6.6129
CLogS	-8.386
H Acceptors	7
H Donors	3
TotalSurfaceArea	440.12
Relative PSA	0.24289
PolarSurfaceArea	132.61
Druglikeness	4.1721
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	42
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	9
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	29
Symmetricatoms	15
Amides	3
StereoCon

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