In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2009 | 34 | 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) | 3.86 | 8.17 | -13.75 | 0 | 7 | 0 | 72 | 476.964 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.86 | 10.36 | -69.81 | 1 | 7 | 1 | 73 | 477.972 | 5 | ↓ |