In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2008 | 17 | 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) | 3.00 | 6.89 | -42.61 | 2 | 4 | 1 | 37 | 242.387 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.00 | 4.97 | -7.29 | 1 | 4 | 0 | 36 | 241.379 | 5 | ↓ |