In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 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) | 2.96 | 5.01 | -47.17 | 0 | 4 | -1 | 61 | 281.382 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.89 | 5.57 | -13.45 | 1 | 4 | 0 | 62 | 282.39 | 2 | ↓ |