In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2009 | 27 | Yes |
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) | 3.69 | 10.85 | -42.17 | 1 | 4 | 1 | 34 | 367.513 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.69 | 10.75 | -43.95 | 1 | 4 | 1 | 34 | 367.513 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.69 | 8.78 | -7.87 | 0 | 4 | 0 | 33 | 366.505 | 8 | ↓ |