N-[(2E,4E)-1-(benzylamino)-1-oxo-5-phenylpenta-2,4-dien-2-yl]benzamide

Formula:C25H22N2O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(2E,4E)-1-(benzylamino)-1-oxo-5-phenylpenta-2,4-dien-2-yl]benzamide is a drug-like molecule.

MolName	N-[(2E,4E)-1-(benzylamino)-1-oxo-5-phenylpenta-2,4-dien-2-yl]benzamide
MolecularFormula	C25H22N2O2
Smiles	O=C(/C(/NC(c1ccccc1)=O)=C\C=C\c1ccccc1)NCc1ccccc1
InChI	InChI=1S/C25H22N2O2/c28-24(22-16-8-3-9-17-22)27-23(18-10-15-20-11-4-1-5-12-20)25(29)26-19-21-13-6-2-7-14-21/h1-18H,19H2,(H,26,29)(H,27,28)
InChIK	DHTBZZPCDDFUJD-UHFFFAOYSA-N
TotalMolweight	382.462
Molweight	382.462
MonoisotopicMass	382.168128
CLogP	4.7898
CLogS	-5.001
H Acceptors	4
H Donors	2
TotalSurfaceArea	316.17
Relative PSA	0.15498
PolarSurfaceArea	58.2
Druglikeness	3.5815
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	high
Nasty Functions
Shape Index	0.51724
Fragments	1
Non HAtoms	29
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	1
Symmetricatoms	6
Amides	2
StereoCon

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