In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2011 | 16 | Yes |
Popular Name: (4R)-4-propyl-1-[[(3R)-pyrrolidin-3-yl]methyl]azepane (4R)-4-propyl-1-[[(3R)-pyrrolidi…
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) | 3.29 | 8.12 | -99.98 | 3 | 2 | 2 | 21 | 226.408 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.29 | 6.28 | -36.33 | 2 | 2 | 1 | 20 | 225.4 | 4 | ↓ |