In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2006 | 24 | 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) | 1.72 | 7.94 | -10.78 | 0 | 6 | 0 | 59 | 329.4 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.72 | 8.24 | -40.05 | 1 | 6 | 1 | 60 | 330.408 | 4 | ↓ |