In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 1st, 2006 | 13 | 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) | 2.99 | 7.59 | -5.41 | 0 | 1 | 0 | 13 | 169.227 | 1 | ↓ |
Lo Low (pH 4.5-6) | 2.99 | 7.64 | -28.36 | 1 | 1 | 1 | 14 | 170.235 | 1 | ↓ |