In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 17 | 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) | 1.44 | 1.73 | -41.84 | 0 | 5 | -1 | 75 | 231.231 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.98 | 4.4 | -7.62 | 1 | 5 | 0 | 72 | 232.239 | 2 | ↓ |