In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 10th, 2009 | 19 | Yes |
Popular Name: (2R)-2-(azepan-1-yl)-N-(4,5-dimethylthiazol-2-yl)propanamide (2R)-2-(azepan-1-yl)-N-(4,5-dime…
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) | 2.39 | 7.55 | -40.75 | 2 | 4 | 1 | 46 | 282.433 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.57 | 6.48 | -32.08 | 1 | 4 | 0 | 53 | 281.425 | 3 | ↓ |