4-[(E)-C-morpholin-4-yl-N-phenylmethoxycarbonimidoyl]-1,2,5-oxadiazol-3-amine
Molecular Formula : C14H17N5O3 | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |4-[(E)-C-morpholin-4-yl-N-phenylmethoxycarbonimidoyl]-1,2,5-oxadiazol-3-amine is a drug-like molecule.
MolName : 4-[(E)-C-morpholin-4-yl-N-phenylmethoxycarbonimidoyl]-1,2,5-oxadiazol-3-amine |
MolecularFormula : C14H17N5O3 |
Smiles : Nc1nonc1/C(/N1CCOCC1)=N\OCc1ccccc1 |
InChI : InChI=1S/C14H17N5O3/c15-13-12(16-22-17-13)14(19-6-8-20-9-7-19)18-21-10-11-4-2-1-3-5-11/h1-5H,6-10H2,(H2,15,17) |
InChIK : SGWFJUZGGXFTGC-UHFFFAOYSA-N |
TotalMolweight : 303.321 |
Molweight : 303.321 |
MonoisotopicMass : 303.13314 |
CLogP : 1.8161 |
CLogS : -1.896 |
H Acceptors : 8 |
H Donors : 1 |
TotalSurfaceArea : 237.32 |
Relative PSA : 0.36398 |
PolarSurfaceArea : 99 |
Druglikeness : 2.9538 |
Mutagenic : none |
Tumorigenic : none |
Reproductive Effective : none |
Irritant : none |
Nasty Functions : |
Shape Index : 0.54545 |
Fragments : 1 |
Non HAtoms : 22 |
NonCHAtoms : 8 |
Electronegative Atoms : 8 |
Rotatable Bond : 4 |
Rings Closures : 3 |
Small Rings : 3 |
Aromatic Rings : 2 |
Aromatic Atoms : 11 |
Sp3Atoms : 7 |
Symmetricatoms : 4 |
Aromatic Nitrogens : 2 |
StereoCon : |