In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 16 | 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) | 1.62 | 8.67 | -39.09 | 1 | 2 | 1 | 22 | 216.304 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.62 | 7.31 | -4.85 | 0 | 2 | 0 | 20 | 215.296 | 2 | ↓ |