| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 17 | Yes |
Popular Name: (2S)-1-[[(1S)-2-amino-1-(5-bromo-2-thienyl)ethyl]-methyl-amino]-3-methoxy-propan-2-ol (2S)-1-[[(1S)-2-amino-1-(5-bromo…
| 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) | 0.90 | -0.25 | -49.78 | 4 | 4 | 1 | 60 | 324.264 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.90 | -0.61 | -4.57 | 3 | 4 | 0 | 59 | 323.256 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.90 | 0.99 | -34.68 | 4 | 4 | 1 | 60 | 324.264 | 7 | ↓ |
