In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 18 | Yes |
Popular Name: 2-[(2S)-2-hydroxy-3-methylamino-propyl]-1,1-dioxo-1,2-benzothiazol-3-one 2-[(2S)-2-hydroxy-3-methylamino-…
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) | -0.39 | -0.88 | -43.09 | 3 | 6 | 1 | 91 | 271.318 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.39 | -2.37 | -12.13 | 2 | 6 | 0 | 87 | 270.31 | 4 | ↓ |