| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 19 | Yes |
Popular Name: (2S)-2-[[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]amino]-3-methyl-butanoic (2S)-2-[[(1S)-1-(1,3-benzothiazo…
| 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) | 1.12 | 7.18 | -29.53 | 2 | 4 | 0 | 70 | 278.377 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.12 | 5.95 | -49.79 | 1 | 4 | -1 | 65 | 277.369 | 5 | ↓ |
