In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 6th, 2006 | 27 | 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) | 0.72 | 7.43 | -202.53 | 2 | 10 | -3 | 179 | 377.329 | 11 | ↓ |
Lo Low (pH 4.5-6) | 0.72 | 5.44 | -120.12 | 3 | 10 | -2 | 176 | 378.337 | 11 | ↓ |