In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 10 | 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) | 0.34 | 0.2 | -44.64 | 6 | 3 | 1 | 66 | 138.194 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.34 | 0.01 | -99.66 | 7 | 3 | 2 | 67 | 139.202 | 2 | ↓ |