[4-[(Z)-[[2-[(3,4-dichlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 2-bromobenzoate

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

MolName	[4-[(Z)-[[2-[(3,4-dichlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 2-bromobenzoate
MolecularFormula	C23H16N3O4BrCl2
Smiles	O=C(CNC(c(cc1)cc(Cl)c1Cl)=O)N/N=C\c(cc1)ccc1OC(c(cccc1)c1Br)=O
InChI	InChI=1S/C23H16BrCl2N3O4/c24-18-4-2-1-3-17(18)23(32)33-16-8-5-14(6-9-16)12-28-29-21(30)13-27-22(31)15-7-10-19(25)20(26)11-15/h1-12H,13H2,(H,27,31)(H,29,30)
InChIK	KHXRHKGZWGSOPF-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	none
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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1 - [4-[(Z)-[[2-[(3,4-dichlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 2-bromobenzoate | 2 - [4-[(Z)-[[2-[(3,4-dichlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 2-bromobenzoate

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