| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 11th, 2010 | 16 | Yes |
Popular Name: 2-[[(1R,2S)-2-amino-1-(4-bromo-2-thienyl)propyl]-methyl-amino]acetamide 2-[[(1R,2S)-2-amino-1-(4-bromo-2…
| 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) | 0.50 | 0.06 | -52.74 | 5 | 4 | 1 | 74 | 307.237 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.50 | -0.46 | -7.74 | 4 | 4 | 0 | 72 | 306.229 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.50 | 1.61 | -124.33 | 6 | 4 | 2 | 75 | 308.245 | 5 | ↓ |
