(Z)-1-[5-(1H-benzimidazol-2-ylsulfanyl)furan-2-yl]-N-(1,2,4-triazol-4-yl)methanimine

Formula:C14H10N6OS Mutagenic:high Tumorigenic:high Reproductive Effective:high (Z)-1-[5-(1H-benzimidazol-2-ylsulfanyl)furan-2-yl]-N-(1,2,4-triazol-4-yl)methanimine is a drug-like molecule.

MolName	(Z)-1-[5-(1H-benzimidazol-2-ylsulfanyl)furan-2-yl]-N-(1,2,4-triazol-4-yl)methanimine
MolecularFormula	C14H10N6OS
Smiles	C(c(o1)ccc1Sc1nc(cccc2)c2[nH]1)=N\n1cnnc1
InChI	InChI=1S/C14H10N6OS/c1-2-4-12-11(3-1)18-14(19-12)22-13-6-5-10(21-13)7-17-20-8-15-16-9-20/h1-9H,(H,18,19)
InChIK	IRKKUGPTUMTUBK-UHFFFAOYSA-N
TotalMolweight	310.34
Molweight	310.34
MonoisotopicMass	310.063679
CLogP	2.1772
CLogS	-5.521
H Acceptors	7
H Donors	1
TotalSurfaceArea	234.37
Relative PSA	0.41336
PolarSurfaceArea	110.19
Druglikeness	6.3975
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.63636
Fragments	1
Non HAtoms	22
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	19
Sp3Atoms	1
Symmetricatoms	2
Aromatic Nitrogens	5
BasicNitrogens	1
StereoCon

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1 - (Z)-1-[5-(1H-benzimidazol-2-ylsulfanyl)furan-2-yl]-N-(1,2,4-triazol-4-yl)methanimine | 2 - (Z)-1-[5-(1H-benzimidazol-2-ylsulfanyl)furan-2-yl]-N-(1,2,4-triazol-4-yl)methanimine

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