In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 20 | Yes |
Popular Name: (2R)-1-[(1R,2S)-2-amino-1-(p-tolyl)propyl]-N-methyl-pyrrolidine-2-carboxamide (2R)-1-[(1R,2S)-2-amino-1-(p-tol…
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) | 1.08 | 4.38 | -112.88 | 5 | 4 | 2 | 61 | 277.412 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.08 | 2.2 | -51.14 | 4 | 4 | 1 | 60 | 276.404 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.08 | 4.05 | -34.69 | 4 | 4 | 1 | 60 | 276.404 | 4 | ↓ |