(Z)-1-(4-bromophenyl)-N-(3,5-diphenyl-1,2,4-triazol-4-yl)methanimine

Formula:C21H15N4Br Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-1-(4-bromophenyl)-N-(3,5-diphenyl-1,2,4-triazol-4-yl)methanimine is not a drug-like molecule.

MolName	(Z)-1-(4-bromophenyl)-N-(3,5-diphenyl-1,2,4-triazol-4-yl)methanimine
MolecularFormula	C21H15N4Br
Smiles	Brc1ccc(/C=N\n2c(-c3ccccc3)nnc2-c2ccccc2)cc1
InChI	InChI=1S/C21H15BrN4/c22-19-13-11-16(12-14-19)15-23-26-20(17-7-3-1-4-8-17)24-25-21(26)18-9-5-2-6-10-18/h1-15H
InChIK	YFQAKBOPVQUFDH-UHFFFAOYSA-N
TotalMolweight	403.282
Molweight	403.282
MonoisotopicMass	402.048007
CLogP	5.2395
CLogS	-9.434
H Acceptors	4
TotalSurfaceArea	282.65
Relative PSA	0.14265
PolarSurfaceArea	43.07
Druglikeness	1.7624
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.5
Fragments	1
Non HAtoms	26
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	23
Symmetricatoms	12
Aromatic Nitrogens	3
StereoCon

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