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

Formula:C23H17N4O6Br Mutagenic:none Tumorigenic:none Reproductive Effective:none [3-[(Z)-[[2-[(2-bromobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 4-nitrobenzoate is not a drug-like molecule.

MolName	[3-[(Z)-[[2-[(2-bromobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 4-nitrobenzoate
MolecularFormula	C23H17N4O6Br
Smiles	[O-][N+](c(cc1)ccc1C(Oc1cccc(/C=N\NC(CNC(c(cccc2)c2Br)=O)=O)c1)=O)=O
InChI	InChI=1S/C23H17BrN4O6/c24-20-7-2-1-6-19(20)22(30)25-14-21(29)27-26-13-15-4-3-5-18(12-15)34-23(31)16-8-10-17(11-9-16)28(32)33/h1-13H,14H2,(H,25,30)(H,27,29)
InChIK	SZLYHTOVVZFFNX-UHFFFAOYSA-N
TotalMolweight	525.314
Molweight	525.314
MonoisotopicMass	524.033147
CLogP	3.5194
CLogS	-6.252
H Acceptors	10
H Donors	2
TotalSurfaceArea	359.77
Relative PSA	0.31679
PolarSurfaceArea	142.68
Druglikeness	-1.7717
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.64706
Fragments	1
Non HAtoms	34
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	9
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	3
Symmetricatoms	2
Amides	1
AcidicOxygens	1
StereoCon

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