In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 27th, 2011 | 20 | 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) | 5.29 | 7.47 | -6.13 | 2 | 3 | 0 | 52 | 276.355 | 7 | ↓ |
Lo Low (pH 4.5-6) | 5.29 | 7.28 | -31.62 | 3 | 3 | 1 | 53 | 277.363 | 7 | ↓ |