In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2011 | 20 | Yes |
Popular Name: (2S)-N-[(3-bromo-4-methoxy-phenyl)methyl]-2-methyl-3-pyrrolidin-1-yl-propan-1-amine (2S)-N-[(3-bromo-4-methoxy-pheny…
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) | 3.47 | 9.17 | -110.39 | 3 | 3 | 2 | 30 | 343.309 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.47 | 6.99 | -46.24 | 2 | 3 | 1 | 29 | 342.301 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.47 | 7.95 | -36.33 | 2 | 3 | 1 | 26 | 342.301 | 7 | ↓ |