[(E)-[1-amino-2-[4-(thiadiazol-4-yl)phenyl]ethylidene]amino] thiadiazole-4-carboxylate

Formula:C13H10N6O2S2 Mutagenic:high Tumorigenic:none Reproductive Effective:none [(E)-[1-amino-2-[4-(thiadiazol-4-yl)phenyl]ethylidene]amino] thiadiazole-4-carboxylate is a drug-like molecule.

MolName	[(E)-[1-amino-2-[4-(thiadiazol-4-yl)phenyl]ethylidene]amino] thiadiazole-4-carboxylate
MolecularFormula	C13H10N6O2S2
Smiles	N/C(/Cc(cc1)ccc1-c1csnn1)=N/OC(c1csnn1)=O
InChI	InChI=1S/C13H10N6O2S2/c14-12(17-21-13(20)11-7-23-19-16-11)5-8-1-3-9(4-2-8)10-6-22-18-15-10/h1-4,6-7H,5H2,(H2,14,17)
InChIK	ZEZRNHAREXCKRR-UHFFFAOYSA-N
TotalMolweight	346.394
Molweight	346.394
MonoisotopicMass	346.030664
CLogP	2.736
CLogS	-4.577
H Acceptors	8
H Donors	1
TotalSurfaceArea	252.7
Relative PSA	0.53194
PolarSurfaceArea	172.72
Druglikeness	-5.5768
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.65217
Fragments	1
Non HAtoms	23
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	2
Symmetricatoms	2
Aromatic Nitrogens	4
StereoCon

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1 - [(E)-[1-amino-2-[4-(thiadiazol-4-yl)phenyl]ethylidene]amino] thiadiazole-4-carboxylate | 2 - [(E)-[1-amino-2-[4-(thiadiazol-4-yl)phenyl]ethylidene]amino] thiadiazole-4-carboxylate

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