In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 27th, 2004 | 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) | 4.05 | 8.67 | -13.12 | 1 | 5 | 0 | 75 | 367.474 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.05 | 0.35 | -44.29 | 2 | 5 | 1 | 76 | 368.482 | 5 | ↓ |