| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 13 | Yes |
Popular Name: (2S)-1-amino-3-[methyl(thiazol-4-ylmethyl)amino]propan-2-ol (2S)-1-amino-3-[methyl(thiazol-4…
None
| 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) | -0.93 | -0.88 | -104.21 | 5 | 4 | 2 | 65 | 203.311 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.93 | -3.27 | -45.57 | 4 | 4 | 1 | 64 | 202.303 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.93 | -3.74 | -7.16 | 3 | 4 | 0 | 62 | 201.295 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.93 | -1.25 | -35.53 | 4 | 4 | 1 | 64 | 202.303 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.93 | -0.33 | -49.61 | 4 | 4 | 1 | 68 | 202.303 | 5 | ↓ |
