In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2008 | 12 | 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) | 1.73 | 4.2 | -7.77 | 1 | 2 | 0 | 36 | 160.22 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.73 | 5.64 | -54.9 | 2 | 2 | 1 | 40 | 161.228 | 3 | ↓ |