In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 26 | 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) | 5.29 | 11.7 | -9.93 | 0 | 4 | 0 | 48 | 345.398 | 7 | ↓ |
Lo Low (pH 4.5-6) | 5.29 | 11.37 | -45.41 | 1 | 4 | 1 | 50 | 346.406 | 7 | ↓ |
Lo Low (pH 4.5-6) | 5.29 | 12.05 | -43.1 | 1 | 4 | 1 | 50 | 346.406 | 7 | ↓ |