In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2005 | 28 | 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) | 5.44 | -3.39 | -8.06 | 2 | 5 | 0 | 75 | 502.162 | 3 | ↓ |
Lo Low (pH 4.5-6) | 5.44 | -3.29 | -37.27 | 3 | 5 | 1 | 76 | 503.17 | 3 | ↓ |