In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2004 | 23 | Yes |
None
None
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) | 3.24 | 10.68 | -41.25 | 1 | 5 | 1 | 57 | 318.393 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.24 | 8.33 | -6.84 | 0 | 5 | 0 | 56 | 317.385 | 6 | ↓ |