2-[2-(4-amino-1,2,5-oxadiazol-3-yl)benzimidazol-1-yl]-N-[(E)-(3-fluorophenyl)methylideneamino]acetamide

Formula:C18H14N7O2F Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[2-(4-amino-1,2,5-oxadiazol-3-yl)benzimidazol-1-yl]-N-[(E)-(3-fluorophenyl)methylideneamino]acetamide is a drug-like molecule.

MolName	2-[2-(4-amino-1,2,5-oxadiazol-3-yl)benzimidazol-1-yl]-N-[(E)-(3-fluorophenyl)methylideneamino]acetamide
MolecularFormula	C18H14N7O2F
Smiles	Nc1nonc1-c1nc(cccc2)c2n1CC(N/N=C/c1cccc(F)c1)=O
InChI	InChI=1S/C18H14FN7O2/c19-12-5-3-4-11(8-12)9-21-23-15(27)10-26-14-7-2-1-6-13(14)22-18(26)16-17(20)25-28-24-16/h1-9H,10H2,(H2,20,25)(H,23,27)
InChIK	UKYDYUNFKRHWJT-UHFFFAOYSA-N
TotalMolweight	379.354
Molweight	379.354
MonoisotopicMass	379.119301
CLogP	2.4488
CLogS	-4.057
H Acceptors	9
H Donors	2
TotalSurfaceArea	285.15
Relative PSA	0.36882
PolarSurfaceArea	124.22
Druglikeness	5.3967
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.5
Fragments	1
Non HAtoms	28
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	20
Sp3Atoms	1
Aromatic Nitrogens	4
BasicNitrogens	1
StereoCon

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1 - 2-[2-(4-amino-1,2,5-oxadiazol-3-yl)benzimidazol-1-yl]-N-[(E)-(3-fluorophenyl)methylideneamino]acetamide | 2 - 2-[2-(4-amino-1,2,5-oxadiazol-3-yl)benzimidazol-1-yl]-N-[(E)-(3-fluorophenyl)methylideneamino]acetamide

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