4-amino-N-[2-[[(E)-3-phenylprop-2-enyl]amino]ethyl]-1,2,5-oxadiazole-3-carboxamide

Formula:C14H17N5O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-amino-N-[2-[[(E)-3-phenylprop-2-enyl]amino]ethyl]-1,2,5-oxadiazole-3-carboxamide is a drug-like molecule.

MolName	4-amino-N-[2-[[(E)-3-phenylprop-2-enyl]amino]ethyl]-1,2,5-oxadiazole-3-carboxamide
MolecularFormula	C14H17N5O2
Smiles	Nc1nonc1C(NCCNC/C=C/c1ccccc1)=O
InChI	InChI=1S/C14H17N5O2/c15-13-12(18-21-19-13)14(20)17-10-9-16-8-4-7-11-5-2-1-3-6-11/h1-7,16H,8-10H2,(H2,15,19)(H,17,20)
InChIK	XYTLSWXOXUYYOQ-UHFFFAOYSA-N
TotalMolweight	287.322
Molweight	287.322
MonoisotopicMass	287.138225
CLogP	0.9504
CLogS	-2.114
H Acceptors	7
H Donors	3
TotalSurfaceArea	237.2
Relative PSA	0.36796
PolarSurfaceArea	106.07
Druglikeness	4.9302
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.71429
Fragments	1
Non HAtoms	21
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	7
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	4
Symmetricatoms	2
Amides	1
Amines	1
AlkylAmines	1
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

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1 - 4-amino-N-[2-[[(E)-3-phenylprop-2-enyl]amino]ethyl]-1,2,5-oxadiazole-3-carboxamide | 2 - 4-amino-N-[2-[[(E)-3-phenylprop-2-enyl]amino]ethyl]-1,2,5-oxadiazole-3-carboxamide

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