In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 37 | No |
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) | 3.87 | 11.62 | -73.43 | 1 | 8 | 0 | 93 | 508.615 | 12 | ↓ |
Mid Mid (pH 6-8) | 2.05 | 5.19 | -8.78 | 0 | 5 | 0 | 42 | 336.457 | 3 | ↓ |