In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 18 | 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) | 3.42 | 4.82 | -45.02 | 3 | 3 | 1 | 50 | 243.33 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.42 | 4.42 | -6.14 | 2 | 3 | 0 | 48 | 242.322 | 4 | ↓ |