2-[4-[(Z)-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]hydrazinylidene]methyl]phenoxy]acetic acid

Formula:C18H17N2O4BrS Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[4-[(Z)-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]hydrazinylidene]methyl]phenoxy]acetic acid is a drug-like molecule.

MolName	2-[4-[(Z)-[[2-[(2-bromophenyl)methylsulfanyl]acetyl]hydrazinylidene]methyl]phenoxy]acetic acid
MolecularFormula	C18H17N2O4BrS
Smiles	OC(COc1ccc(/C=N\NC(CSCc(cccc2)c2Br)=O)cc1)=O
InChI	InChI=1S/C18H17BrN2O4S/c19-16-4-2-1-3-14(16)11-26-12-17(22)21-20-9-13-5-7-15(8-6-13)25-10-18(23)24/h1-9H,10-12H2,(H,21,22)(H,23,24)
InChIK	CYAITBUAKDDNBK-UHFFFAOYSA-N
TotalMolweight	437.313
Molweight	437.313
MonoisotopicMass	436.009239
CLogP	3.1764
CLogS	-5.134
H Acceptors	6
H Donors	2
TotalSurfaceArea	298.49
Relative PSA	0.30031
PolarSurfaceArea	113.29
Druglikeness	2.8105
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.73077
Fragments	1
Non HAtoms	26
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	9
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	6
Symmetricatoms	2
AcidicOxygens	1
StereoCon

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