(Z)-1-[4-[3-(4-bromophenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]phenyl]-N-(1,2,4-triazol-4-yl)methanimine

Formula:C24H19N6Br Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-1-[4-[3-(4-bromophenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]phenyl]-N-(1,2,4-triazol-4-yl)methanimine is not a drug-like molecule.

MolName	(Z)-1-[4-[3-(4-bromophenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]phenyl]-N-(1,2,4-triazol-4-yl)methanimine
MolecularFormula	C24H19N6Br
Smiles	Brc1ccc(C(C2)N(c3ccc(/C=N\n4cnnc4)cc3)N=C2c2ccccc2)cc1
InChI	InChI=1S/C24H19BrN6/c25-21-10-8-20(9-11-21)24-14-23(19-4-2-1-3-5-19)29-31(24)22-12-6-18(7-13-22)15-28-30-16-26-27-17-30/h1-13,15-17,24H,14H2/t24-/m0/s1
InChIK	SGASLFZECLGWMB-DEOSSOPVSA-N
TotalMolweight	471.361
Molweight	471.361
MonoisotopicMass	470.085455
CLogP	5.4159
CLogS	-8.077
H Acceptors	6
TotalSurfaceArea	328.68
Relative PSA	0.16849
PolarSurfaceArea	58.67
Druglikeness	2.509
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.51613
Fragments	1
Non HAtoms	31
NonCHAtoms	7
Electronegative Atoms	7
StereoCenters	1
Rotatable Bond	5
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	23
Sp3Atoms	2
Symmetricatoms	8
Aromatic Nitrogens	3
StereoCon	racemate

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1 - (Z)-1-[4-[3-(4-bromophenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]phenyl]-N-(1,2,4-triazol-4-yl)methanimine | 2 - (Z)-1-[4-[3-(4-bromophenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]phenyl]-N-(1,2,4-triazol-4-yl)methanimine

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