In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2007 | 17 | 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) | 2.66 | -0.42 | -9.87 | 1 | 3 | 0 | 41 | 295.111 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.66 | -0.31 | -39.59 | 2 | 3 | 1 | 43 | 296.119 | 2 | ↓ |