In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 18 | No |
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) | 1.32 | 6.04 | -10.49 | 1 | 6 | 0 | 84 | 244.254 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.32 | 6.48 | -41.7 | 2 | 6 | 1 | 85 | 245.262 | 5 | ↓ |