In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2009 | 24 | Yes |
Popular Name: (2R)-N-(1,3-benzothiazol-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)propanamide (2R)-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) | 3.42 | 8.14 | -15.82 | 1 | 4 | 0 | 45 | 337.448 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.61 | 8.78 | -37.92 | 1 | 4 | 0 | 53 | 337.448 | 3 | ↓ |