In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2009 | 33 | 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) | 5.91 | 14.09 | -9.64 | 0 | 3 | 0 | 24 | 461.049 | 7 | ↓ |
Mid Mid (pH 6-8) | 5.91 | 16.53 | -44.13 | 1 | 3 | 1 | 25 | 462.057 | 7 | ↓ |