In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2010 | 38 | 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) | 0.90 | 1.03 | -54.13 | 7 | 11 | 1 | 187 | 528.534 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.90 | 0.62 | -19.9 | 6 | 11 | 0 | 186 | 527.526 | 4 | ↓ |