N-[(Z)-1-[5-(4-bromophenyl)furan-2-yl]-3-(3-hydroxypropylamino)-3-oxoprop-1-en-2-yl]benzamide

Formula:C23H21N2O4Br Mutagenic:high Tumorigenic:high Reproductive Effective:none N-[(Z)-1-[5-(4-bromophenyl)furan-2-yl]-3-(3-hydroxypropylamino)-3-oxoprop-1-en-2-yl]benzamide is a drug-like molecule.

MolName	N-[(Z)-1-[5-(4-bromophenyl)furan-2-yl]-3-(3-hydroxypropylamino)-3-oxoprop-1-en-2-yl]benzamide
MolecularFormula	C23H21N2O4Br
Smiles	OCCCNC(/C(/NC(c1ccccc1)=O)=C/c1ccc(-c(cc2)ccc2Br)o1)=O
InChI	InChI=1S/C23H21BrN2O4/c24-18-9-7-16(8-10-18)21-12-11-19(30-21)15-20(23(29)25-13-4-14-27)26-22(28)17-5-2-1-3-6-17/h1-3,5-12,15,27H,4,13-14H2,(H,25,29)(H,26,28)
InChIK	MNIZLRFBLBGAPF-UHFFFAOYSA-N
TotalMolweight	469.334
Molweight	469.334
MonoisotopicMass	468.068469
CLogP	4.3132
CLogS	-5.723
H Acceptors	6
H Donors	3
TotalSurfaceArea	331.86
Relative PSA	0.22965
PolarSurfaceArea	91.57
Druglikeness	0.79082
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.53333
Fragments	1
Non HAtoms	30
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	4
Symmetricatoms	4
Amides	2
StereoCon

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