In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 20 | Yes |
Popular Name: [4-(aminomethyl)phenyl]-[(3R)-3-pyrrolidin-1-ylpyrrolidin-1-yl]methanone [4-(aminomethyl)phenyl]-[(3R)-3-…
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) | 0.64 | 5.87 | -98.98 | 4 | 4 | 2 | 52 | 275.396 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.64 | 5.47 | -43.18 | 3 | 4 | 1 | 51 | 274.388 | 3 | ↓ |