In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 15 | 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) | 2.07 | 7.28 | -10.45 | 0 | 3 | 0 | 30 | 195.225 | 1 | ↓ |
Lo Low (pH 4.5-6) | 2.07 | 7.6 | -28.33 | 1 | 3 | 1 | 31 | 196.233 | 1 | ↓ |