In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 25th, 2008 | 28 | 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) | 2.76 | 10.44 | -76.49 | 1 | 6 | 0 | 78 | 382.46 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.76 | 9.47 | -47.23 | 2 | 6 | 1 | 75 | 383.468 | 7 | ↓ |