In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 8th, 2010 | 23 | 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) | 2.46 | 4.29 | -9.46 | 1 | 5 | 0 | 51 | 318.417 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.46 | 6.56 | -45.17 | 2 | 5 | 1 | 52 | 319.425 | 6 | ↓ |