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

Formula:C23H19N2O3Br Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-bromo-N-[(2E,4E)-1-(furan-2-ylmethylamino)-1-oxo-5-phenylpenta-2,4-dien-2-yl]benzamide is a drug-like molecule.

MolName	4-bromo-N-[(2E,4E)-1-(furan-2-ylmethylamino)-1-oxo-5-phenylpenta-2,4-dien-2-yl]benzamide
MolecularFormula	C23H19N2O3Br
Smiles	O=C(/C(/NC(c(cc1)ccc1Br)=O)=C\C=C\c1ccccc1)NCc1ccco1
InChI	InChI=1S/C23H19BrN2O3/c24-19-13-11-18(12-14-19)22(27)26-21(10-4-8-17-6-2-1-3-7-17)23(28)25-16-20-9-5-15-29-20/h1-15H,16H2,(H,25,28)(H,26,27)
InChIK	UCIJQGCLKXWEOW-UHFFFAOYSA-N
TotalMolweight	451.319
Molweight	451.319
MonoisotopicMass	450.057904
CLogP	4.7037
CLogS	-5.517
H Acceptors	5
H Donors	2
TotalSurfaceArea	324.49
Relative PSA	0.19449
PolarSurfaceArea	71.34
Druglikeness	1.4738
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	high
Nasty Functions
Shape Index	0.51724
Fragments	1
Non HAtoms	29
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	1
Symmetricatoms	4
Amides	2
StereoCon

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