| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 19th, 2009 | 17 | No |
Popular Name: 4-[(1S)-2-[[(1S)-3-amino-1-methyl-propyl]amino]-1-hydroxy-ethyl]benzene-1,2-diol 4-[(1S)-2-[[(1S)-3-amino-1-methy…
| 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) | -0.65 | -4.7 | -57.1 | 7 | 5 | 1 | 100 | 241.311 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.65 | -3.68 | -44.5 | 7 | 5 | 1 | 103 | 241.311 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.65 | -4.98 | -8.28 | 6 | 5 | 0 | 99 | 240.303 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.65 | -3.32 | -124.47 | 8 | 5 | 2 | 105 | 242.319 | 6 | ↓ |
