In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2006 | 29 | 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) | 7.01 | 14.24 | -9.67 | 0 | 3 | 0 | 39 | 385.507 | 8 | ↓ |
Lo Low (pH 4.5-6) | 7.01 | 14.56 | -40.68 | 1 | 3 | 1 | 40 | 386.515 | 8 | ↓ |