In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 21 | 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) | 3.37 | 8.01 | -30.34 | 2 | 3 | 1 | 29 | 291.459 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.37 | 8.97 | -34.85 | 2 | 3 | 1 | 26 | 291.459 | 8 | ↓ |