2-[2-[(Z)-[2-(1-benzofuran-2-yl)-4-oxoquinazolin-3-yl]iminomethyl]-4-bromophenoxy]acetamide

Formula:C25H17N4O4Br Mutagenic:high Tumorigenic:none Reproductive Effective:none 2-[2-[(Z)-[2-(1-benzofuran-2-yl)-4-oxoquinazolin-3-yl]iminomethyl]-4-bromophenoxy]acetamide is not a drug-like molecule.

MolName	2-[2-[(Z)-[2-(1-benzofuran-2-yl)-4-oxoquinazolin-3-yl]iminomethyl]-4-bromophenoxy]acetamide
MolecularFormula	C25H17N4O4Br
Smiles	NC(COc(cc1)c(/C=N\N(C(c2cc(cccc3)c3o2)=Nc2c3cccc2)C3=O)cc1Br)=O
InChI	InChI=1S/C25H17BrN4O4/c26-17-9-10-20(33-14-23(27)31)16(11-17)13-28-30-24(22-12-15-5-1-4-8-21(15)34-22)29-19-7-3-2-6-18(19)25(30)32/h1-13H,14H2,(H2,27,31)
InChIK	WPAZMDHAKYTDHT-UHFFFAOYSA-N
TotalMolweight	517.338
Molweight	517.338
MonoisotopicMass	516.043317
CLogP	4.0115
CLogS	-6.686
H Acceptors	8
H Donors	1
TotalSurfaceArea	348.01
Relative PSA	0.26445
PolarSurfaceArea	110.49
Druglikeness	2.5599
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.44118
Fragments	1
Non HAtoms	34
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	2
Amides	1
StereoCon

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