[5-amino-2-[(E)-2-[4-amino-2-(benzenesulfonyloxy)phenyl]ethenyl]phenyl] benzenesulfonate

Formula:C26H22N2O6S2 Mutagenic:high Tumorigenic:high Reproductive Effective:none [5-amino-2-[(E)-2-[4-amino-2-(benzenesulfonyloxy)phenyl]ethenyl]phenyl] benzenesulfonate is not a drug-like molecule.

MolName	[5-amino-2-[(E)-2-[4-amino-2-(benzenesulfonyloxy)phenyl]ethenyl]phenyl] benzenesulfonate
MolecularFormula	C26H22N2O6S2
Smiles	Nc1cc(OS(c2ccccc2)(=O)=O)c(/C=C/c(ccc(N)c2)c2OS(c2ccccc2)(=O)=O)cc1
InChI	InChI=1S/C26H22N2O6S2/c27-21-15-13-19(25(17-21)33-35(29,30)23-7-3-1-4-8-23)11-12-20-14-16-22(28)18-26(20)34-36(31,32)24-9-5-2-6-10-24/h1-18H,27-28H2
InChIK	OXYNZBIZNLZJTC-UHFFFAOYSA-N
TotalMolweight	522.601
Molweight	522.601
MonoisotopicMass	522.091928
CLogP	4.2698
CLogS	-5.452
H Acceptors	8
H Donors	2
TotalSurfaceArea	373.24
Relative PSA	0.28855
PolarSurfaceArea	155.54
Druglikeness	-7.6707
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	high
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	36
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	8
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	24
Sp3Atoms	4
Symmetricatoms	21
Amines	2
Aromatic Amines	2
StereoCon

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