(E)-1-[4-[(6-bromo-4-phenylquinazolin-2-yl)amino]phenyl]-3-phenylprop-2-en-1-one

Formula:C29H20N3OBr Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-1-[4-[(6-bromo-4-phenylquinazolin-2-yl)amino]phenyl]-3-phenylprop-2-en-1-one is not a drug-like molecule.

MolName	(E)-1-[4-[(6-bromo-4-phenylquinazolin-2-yl)amino]phenyl]-3-phenylprop-2-en-1-one
MolecularFormula	C29H20N3OBr
Smiles	O=C(/C=C/c1ccccc1)c(cc1)ccc1Nc1nc(-c2ccccc2)c(cc(cc2)Br)c2n1
InChI	InChI=1S/C29H20BrN3O/c30-23-14-17-26-25(19-23)28(22-9-5-2-6-10-22)33-29(32-26)31-24-15-12-21(13-16-24)27(34)18-11-20-7-3-1-4-8-20/h1-19H,(H,31,32,33)
InChIK	NKUYCGFHJUTOAQ-UHFFFAOYSA-N
TotalMolweight	506.402
Molweight	506.402
MonoisotopicMass	505.078973
CLogP	7.4328
CLogS	-8.798
H Acceptors	4
H Donors	1
TotalSurfaceArea	359
Relative PSA	0.12936
PolarSurfaceArea	54.88
Druglikeness	-0.975
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.55882
Fragments	1
Non HAtoms	34
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	28
Symmetricatoms	6
Aromatic Nitrogens	2
StereoCon

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