In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 26 | 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) | 1.94 | 7.48 | -39.52 | 6 | 8 | 1 | 131 | 355.422 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.94 | 7.54 | -19.18 | 5 | 8 | 0 | 129 | 354.414 | 4 | ↓ |