In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 28th, 2009 | 25 | 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) | 6.01 | 14.56 | -4.87 | 0 | 1 | 0 | 3 | 327.471 | 5 | ↓ |
Lo Low (pH 4.5-6) | 6.01 | 14.98 | -33.87 | 1 | 1 | 1 | 4 | 328.479 | 5 | ↓ |