2-[(E)-2-(4-bromophenyl)ethenyl]-3-(2-phenylethyl)quinazolin-4-one

Formula:C24H19N2OBr Mutagenic:none Tumorigenic:none Reproductive Effective:low 2-[(E)-2-(4-bromophenyl)ethenyl]-3-(2-phenylethyl)quinazolin-4-one is not a drug-like molecule.

MolName	2-[(E)-2-(4-bromophenyl)ethenyl]-3-(2-phenylethyl)quinazolin-4-one
MolecularFormula	C24H19N2OBr
Smiles	O=C1N(CCc2ccccc2)C(/C=C/c(cc2)ccc2Br)=Nc2c1cccc2
InChI	InChI=1S/C24H19BrN2O/c25-20-13-10-19(11-14-20)12-15-23-26-22-9-5-4-8-21(22)24(28)27(23)17-16-18-6-2-1-3-7-18/h1-15H,16-17H2
InChIK	DBPLXBLACOWYGV-UHFFFAOYSA-N
TotalMolweight	431.332
Molweight	431.332
MonoisotopicMass	430.068074
CLogP	5.3883
CLogS	-5.482
H Acceptors	3
TotalSurfaceArea	302.95
Relative PSA	0.092755
PolarSurfaceArea	32.67
Druglikeness	1.4887
Mutagenic	none
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.53571
Fragments	1
Non HAtoms	28
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Symmetricatoms	4
Amides	1
StereoCon

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