In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 29th, 2008 | 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) | 2.80 | 7.96 | -19.81 | 1 | 8 | 0 | 92 | 461.566 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.80 | 9.95 | -57.72 | 2 | 8 | 1 | 93 | 462.574 | 7 | ↓ |