N-[(Z)-(4-bromophenyl)methylideneamino]-2-(4-oxo-3H-phthalazin-1-yl)acetamide

Formula:C17H13N4O2Br Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(4-bromophenyl)methylideneamino]-2-(4-oxo-3H-phthalazin-1-yl)acetamide is a drug-like molecule.

MolName	N-[(Z)-(4-bromophenyl)methylideneamino]-2-(4-oxo-3H-phthalazin-1-yl)acetamide
MolecularFormula	C17H13N4O2Br
Smiles	O=C(CC(c1c2cccc1)=NNC2=O)N/N=C\c(cc1)ccc1Br
InChI	InChI=1S/C17H13BrN4O2/c18-12-7-5-11(6-8-12)10-19-21-16(23)9-15-13-3-1-2-4-14(13)17(24)22-20-15/h1-8,10H,9H2,(H,21,23)(H,22,24)
InChIK	BTYQWZJHDRQFMD-UHFFFAOYSA-N
TotalMolweight	385.22
Molweight	385.22
MonoisotopicMass	384.022187
CLogP	3.4259
CLogS	-5.666
H Acceptors	6
H Donors	2
TotalSurfaceArea	258.06
Relative PSA	0.27908
PolarSurfaceArea	82.92
Druglikeness	2.9439
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.625
Fragments	1
Non HAtoms	24
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	2
StereoCon

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