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C14H17N5O3 | Cheminformatics

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 :

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