2-[5-[(Z)-[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]furan-2-yl]benzoic acid

Formula:C15H13N7O4 Mutagenic:high Tumorigenic:high Reproductive Effective:high 2-[5-[(Z)-[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]furan-2-yl]benzoic acid is not a drug-like molecule.

MolName	2-[5-[(Z)-[[2-(5-aminotetrazol-1-yl)acetyl]hydrazinylidene]methyl]furan-2-yl]benzoic acid
MolecularFormula	C15H13N7O4
Smiles	Nc1nnnn1CC(N/N=C\c1ccc(-c(cccc2)c2C(O)=O)o1)=O
InChI	InChI=1S/C15H13N7O4/c16-15-19-20-21-22(15)8-13(23)18-17-7-9-5-6-12(26-9)10-3-1-2-4-11(10)14(24)25/h1-7H,8H2,(H,18,23)(H,24,25)(H2,16,19,21)
InChIK	JSCMUHLUKSTBKG-UHFFFAOYSA-N
TotalMolweight	355.313
Molweight	355.313
MonoisotopicMass	355.102903
CLogP	0.6045
CLogS	-4.339
H Acceptors	11
H Donors	3
TotalSurfaceArea	268.3
Relative PSA	0.48941
PolarSurfaceArea	161.52
Druglikeness	5.8886
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.57692
Fragments	1
Non HAtoms	26
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	2
Aromatic Nitrogens	4
AcidicOxygens	1
StereoCon

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