In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 13th, 2009 | 29 | 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) | 5.64 | 13 | -58.77 | 0 | 4 | -1 | 62 | 394.397 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.64 | 12.98 | -41.58 | 1 | 4 | 0 | 63 | 395.405 | 4 | ↓ |