In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 30th, 2009 | 24 | 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) | 4.51 | 11.25 | -84.23 | 2 | 3 | 2 | 22 | 319.452 | 2 | ↓ |
Mid Mid (pH 6-8) | 4.51 | 8.78 | -25.13 | 1 | 3 | 1 | 21 | 318.444 | 2 | ↓ |