[4-[(Z)-[[2-[(3-bromobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate

Formula:C23H16N3O4BrCl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none [4-[(Z)-[[2-[(3-bromobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate is not a drug-like molecule.

MolName	[4-[(Z)-[[2-[(3-bromobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate
MolecularFormula	C23H16N3O4BrCl2
Smiles	O=C(CNC(c1cccc(Br)c1)=O)N/N=C\c(cc1)ccc1OC(c(ccc(Cl)c1)c1Cl)=O
InChI	InChI=1S/C23H16BrCl2N3O4/c24-16-3-1-2-15(10-16)22(31)27-13-21(30)29-28-12-14-4-7-18(8-5-14)33-23(32)19-9-6-17(25)11-20(19)26/h1-12H,13H2,(H,27,31)(H,29,30)
InChIK	MKEGYHGYXVDYIE-UHFFFAOYSA-N
TotalMolweight	549.207
Molweight	549.207
MonoisotopicMass	546.970122
CLogP	5.653
CLogS	-7.264
H Acceptors	7
H Donors	2
TotalSurfaceArea	366.94
Relative PSA	0.22769
PolarSurfaceArea	96.86
Druglikeness	3.3116
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	low
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.66667
Fragments	1
Non HAtoms	33
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Symmetricatoms	2
Amides	1
StereoCon

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