In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 19 | Yes |
Popular Name: (1S,8aR)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine (1S,8aR)-N-[(1,3,5-trimethylpyra…
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) | 1.36 | 6.19 | -36.15 | 2 | 4 | 1 | 34 | 263.409 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.36 | 5.09 | -43.52 | 2 | 4 | 1 | 38 | 263.409 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.36 | 7.35 | -113.69 | 3 | 4 | 2 | 39 | 264.417 | 3 | ↓ |