| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 13th, 2011 | 16 | Yes |
Popular Name: 1-[(2S)-1-[(3-bromo-2-thienyl)methyl]pyrrolidin-2-yl]-N,N-dimethyl-methanamine 1-[(2S)-1-[(3-bromo-2-thienyl)me…
| 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) | 2.80 | 7.55 | -29.81 | 1 | 2 | 1 | 8 | 304.277 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.80 | 4.91 | -2.09 | 0 | 2 | 0 | 6 | 303.269 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.80 | 9.32 | -97.02 | 2 | 2 | 2 | 9 | 305.285 | 4 | ↓ |
