4-[(E)-2-(4-diazonio-2-sulfophenyl)ethenyl]-3-sulfobenzenediazonium

Formula:C14H10N4O6S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-[(E)-2-(4-diazonio-2-sulfophenyl)ethenyl]-3-sulfobenzenediazonium is a drug-like molecule.

MolName	4-[(E)-2-(4-diazonio-2-sulfophenyl)ethenyl]-3-sulfobenzenediazonium
MolecularFormula	C14H10N4O6S2
Smiles	N#[N+]c1cc(S(O)(=O)=O)c(/C=C/c(ccc([N+]#N)c2)c2S(O)(=O)=O)cc1
InChI	InChI=1S/C14H8N4O6S2/c15-17-11-5-3-9(13(7-11)25(19,20)21)1-2-10-4-6-12(18-16)8-14(10)26(22,23)24/h1-8H/p+2
InChIK	LENCUDCCCFORSC-UHFFFAOYSA-P
TotalMolweight	394.387
Molweight	394.387
MonoisotopicMass	394.004176
CLogP	-1.0752
CLogS	-2.3
H Acceptors	10
H Donors	2
TotalSurfaceArea	278.52
Relative PSA	0.5242
PolarSurfaceArea	181.8
Druglikeness	-4.2945
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	low
Nasty Functions
Shape Index	0.53846
Fragments	1
Non HAtoms	26
NonCHAtoms	12
Electronegative Atoms	12
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Symmetricatoms	14
AcidicOxygens	2
StereoCon

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