In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 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) | 4.58 | 14.26 | -71.73 | 1 | 9 | 0 | 120 | 517.582 | 11 | ↓ |
Lo Low (pH 4.5-6) | 4.58 | 13.52 | -54.68 | 2 | 9 | 1 | 117 | 518.59 | 11 | ↓ |