3-(4-bromophenyl)-5-[(E)-2-(4-bromophenyl)ethenyl]-2-(3,4-dichlorophenyl)-3,4-dihydropyrazole

Formula:C23H16N2Br2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:low 3-(4-bromophenyl)-5-[(E)-2-(4-bromophenyl)ethenyl]-2-(3,4-dichlorophenyl)-3,4-dihydropyrazole is not a drug-like molecule.

MolName	3-(4-bromophenyl)-5-[(E)-2-(4-bromophenyl)ethenyl]-2-(3,4-dichlorophenyl)-3,4-dihydropyrazole
MolecularFormula	C23H16N2Br2Cl2
Smiles	Clc(ccc(N(C(C1)c(cc2)ccc2Br)N=C1/C=C/c(cc1)ccc1Br)c1)c1Cl
InChI	InChI=1S/C23H16Br2Cl2N2/c24-17-6-1-15(2-7-17)3-10-19-13-23(16-4-8-18(25)9-5-16)29(28-19)20-11-12-21(26)22(27)14-20/h1-12,14,23H,13H2/t23-/m1/s1
InChIK	WZWOTRPZMUXOBB-HSZRJFAPSA-N
TotalMolweight	551.108
Molweight	551.108
MonoisotopicMass	547.905724
CLogP	8.3344
CLogS	-7.835
H Acceptors	2
TotalSurfaceArea	333.41
Relative PSA	0.04517
PolarSurfaceArea	15.6
Druglikeness	1.0811
Mutagenic	none
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.51724
Fragments	1
Non HAtoms	29
NonCHAtoms	6
Electronegative Atoms	6
StereoCenters	1
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Symmetricatoms	4
StereoCon	racemate

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