In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 16 | 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) | 0.15 | -0.01 | -45.16 | 0 | 6 | -1 | 99 | 214.16 | 1 | ↓ |
Lo Low (pH 4.5-6) | -0.30 | 2.65 | -11.91 | 1 | 6 | 0 | 96 | 215.168 | 1 | ↓ |