In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2005 | 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) | 3.00 | 8.23 | -47.89 | 0 | 3 | -1 | 53 | 226.255 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.00 | 8.53 | -36.49 | 1 | 3 | 0 | 54 | 227.263 | 2 | ↓ |