[(Z)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino] 2-iodobenzoate

Formula:C10H8N5O3I Mutagenic:high Tumorigenic:high Reproductive Effective:none [(Z)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino] 2-iodobenzoate is a drug-like molecule.

MolName	[(Z)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino] 2-iodobenzoate
MolecularFormula	C10H8N5O3I
Smiles	N/C(/c1nonc1N)=N\OC(c(cccc1)c1I)=O
InChI	InChI=1S/C10H8IN5O3/c11-6-4-2-1-3-5(6)10(17)18-15-8(12)7-9(13)16-19-14-7/h1-4H,(H2,12,15)(H2,13,16)
InChIK	TZPQNLNEHHPPSQ-UHFFFAOYSA-N
TotalMolweight	373.106
Molweight	373.106
MonoisotopicMass	372.967188
CLogP	1.7486
CLogS	-3.42
H Acceptors	8
H Donors	2
TotalSurfaceArea	214.27
Relative PSA	0.47202
PolarSurfaceArea	129.62
Druglikeness	-1.9025
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.57895
Fragments	1
Non HAtoms	19
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	1
Aromatic Nitrogens	2
StereoCon

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1 - [(Z)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino] 2-iodobenzoate | 2 - [(Z)-[amino-(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino] 2-iodobenzoate

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