N-[(Z)-1-azabicyclo[2.2.2]octan-3-ylideneamino]-2H-tetrazol-5-amine
Molecular Formula : C8H13N7 | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |N-[(Z)-1-azabicyclo[2.2.2]octan-3-ylideneamino]-2H-tetrazol-5-amine is a drug-like molecule.
MolName : N-[(Z)-1-azabicyclo[2.2.2]octan-3-ylideneamino]-2H-tetrazol-5-amine |
MolecularFormula : C8H13N7 |
Smiles : C(CN(CC1)C2)C1/C2=N/Nc1n[nH]nn1 |
InChI : InChI=1S/C8H13N7/c1-3-15-4-2-6(1)7(5-15)9-10-8-11-13-14-12-8/h6H,1-5H2,(H2,10,11,12,13,14) |
InChIK : IKCBOJZPHTXFHV-UHFFFAOYSA-N |
TotalMolweight : 207.24 |
Molweight : 207.24 |
MonoisotopicMass : 207.123243 |
CLogP : 1.6622 |
CLogS : -1.308 |
H Acceptors : 7 |
H Donors : 2 |
TotalSurfaceArea : 158.14 |
Relative PSA : 0.46427 |
PolarSurfaceArea : 82.09 |
Druglikeness : 2.4614 |
Mutagenic : none |
Tumorigenic : none |
Reproductive Effective : none |
Irritant : none |
Nasty Functions : |
Shape Index : 0.6 |
Fragments : 1 |
Non HAtoms : 15 |
NonCHAtoms : 7 |
Electronegative Atoms : 7 |
Rotatable Bond : 2 |
Rings Closures : 3 |
Small Rings : 4 |
Aromatic Rings : 1 |
Aromatic Atoms : 5 |
Sp3Atoms : 7 |
Symmetricatoms : 2 |
Amines : 1 |
AlkylAmines : 1 |
Aromatic Nitrogens : 4 |
BasicNitrogens : 1 |
StereoCon : |