In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 15 | 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 | 6.74 | -42.11 | 0 | 1 | -1 | 23 | 199.273 | 1 | ↓ |
Mid Mid (pH 6-8) | 3.42 | 6.45 | -3.01 | 1 | 1 | 0 | 20 | 200.281 | 1 | ↓ |