In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 15th, 2010 | 26 | Yes |
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) | 6.27 | 14.62 | -10.23 | 0 | 2 | 0 | 18 | 340.47 | 3 | ↓ |
Lo Low (pH 4.5-6) | 6.27 | 14.97 | -27.8 | 1 | 2 | 1 | 19 | 341.478 | 3 | ↓ |