In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 18 | Yes |
Popular Name: (1S,8aR)-N-[(1S)-1-(2-pyridyl)ethyl]-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine (1S,8aR)-N-[(1S)-1-(2-pyridyl)et…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.93 | 6.58 | -31.53 | 2 | 3 | 1 | 29 | 246.378 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.93 | 5.32 | -33.06 | 2 | 3 | 1 | 33 | 246.378 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.93 | 7.58 | -101.18 | 3 | 3 | 2 | 34 | 247.386 | 3 | ↓ |