In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 18 | Yes |
Popular Name: (1S,8aR)-N-phenethyl-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine (1S,8aR)-N-phenethyl-1,2,3,5,6,7…
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) | 2.95 | 8.26 | -31.39 | 2 | 2 | 1 | 16 | 245.39 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.95 | 6 | -1.99 | 1 | 2 | 0 | 15 | 244.382 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.95 | 9.4 | -111.38 | 3 | 2 | 2 | 21 | 246.398 | 4 | ↓ |