5-[(Z)-[[2-(5-phenyltetrazol-2-yl)acetyl]hydrazinylidene]methyl]furan-2-sulfonate

Formula:C14H11N6O5S Mutagenic:high Tumorigenic:high Reproductive Effective:none 5-[(Z)-[[2-(5-phenyltetrazol-2-yl)acetyl]hydrazinylidene]methyl]furan-2-sulfonate is not a drug-like molecule.

MolName	5-[(Z)-[[2-(5-phenyltetrazol-2-yl)acetyl]hydrazinylidene]methyl]furan-2-sulfonate
MolecularFormula	C14H11N6O5S
Smiles	[O-]S(c1ccc(/C=N\NC(Cn2nnc(-c3ccccc3)n2)=O)o1)(=O)=O
InChI	InChI=1S/C14H12N6O5S/c21-12(16-15-8-11-6-7-13(25-11)26(22,23)24)9-20-18-14(17-19-20)10-4-2-1-3-5-10/h1-8H,9H2,(H,16,21)(H,22,23,24)/p-1
InChIK	DOWYZRDQXNNSHS-UHFFFAOYSA-M
TotalMolweight	375.344
Molweight	375.344
MonoisotopicMass	375.051164
CLogP	-1.6779
CLogS	-1.84
H Acceptors	11
H Donors	1
TotalSurfaceArea	271.79
Relative PSA	0.48847
PolarSurfaceArea	163.78
Druglikeness	-3.0846
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.65385
Fragments	1
Non HAtoms	26
NonCHAtoms	12
Electronegative Atoms	12
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	3
Symmetricatoms	3
Aromatic Nitrogens	4
AcidicOxygens	1
StereoCon

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