In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 18 | 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) | 1.76 | 5.7 | -16.17 | 1 | 3 | 0 | 42 | 244.269 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.76 | 6.16 | -43.79 | 2 | 3 | 1 | 43 | 245.277 | 4 | ↓ |