In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 22nd, 2008 | 19 | 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) | 4.31 | 8.51 | -9.51 | 2 | 2 | 0 | 39 | 264.353 | 1 | ↓ |
Lo Low (pH 4.5-6) | 4.31 | 8.71 | -30.68 | 3 | 2 | 1 | 40 | 265.361 | 1 | ↓ |