5-[(2Z)-2-[(4-bromophenyl)methylidene]hydrazinyl]-2-chlorobenzoic acid

Formula:C14H10N2O2BrCl Mutagenic:none Tumorigenic:high Reproductive Effective:none 5-[(2Z)-2-[(4-bromophenyl)methylidene]hydrazinyl]-2-chlorobenzoic acid is not a drug-like molecule.

MolName	5-[(2Z)-2-[(4-bromophenyl)methylidene]hydrazinyl]-2-chlorobenzoic acid
MolecularFormula	C14H10N2O2BrCl
Smiles	OC(c(cc(cc1)N/N=C\c(cc2)ccc2Br)c1Cl)=O
InChI	InChI=1S/C14H10BrClN2O2/c15-10-3-1-9(2-4-10)8-17-18-11-5-6-13(16)12(7-11)14(19)20/h1-8,18H,(H,19,20)
InChIK	PBRFOJWSDVHVOE-UHFFFAOYSA-N
TotalMolweight	353.602
Molweight	353.602
MonoisotopicMass	351.961416
CLogP	5.6572
CLogS	-4.732
H Acceptors	4
H Donors	2
TotalSurfaceArea	227.39
Relative PSA	0.21597
PolarSurfaceArea	61.69
Druglikeness	0.11833
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.65
Fragments	1
Non HAtoms	20
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	2
AcidicOxygens	1
StereoCon

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