In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 19 | Yes |
Popular Name: (1S,8aR)-N-[(1S)-1-(5-ethyl-2-thienyl)ethyl]-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine (1S,8aR)-N-[(1S)-1-(5-ethyl-2-th…
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) | 3.79 | 8.86 | -31.7 | 2 | 2 | 1 | 16 | 279.473 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.79 | 7.62 | -35.06 | 2 | 2 | 1 | 20 | 279.473 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.79 | 9.88 | -105.33 | 3 | 2 | 2 | 21 | 280.481 | 4 | ↓ |