In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 30th, 2008 | 23 | Yes |
Popular Name: (2S)-N-(1,3-benzothiazol-2-yl)-2-(3,4-dimethylphenoxy)propanamide (2S)-N-(1,3-benzothiazol-2-yl)-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) | 4.54 | 9.72 | -16.23 | 1 | 4 | 0 | 51 | 326.421 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.73 | 8.64 | -46.41 | 0 | 4 | -1 | 58 | 325.413 | 4 | ↓ |