In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 12th, 2010 | 38 | 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) | 6.08 | 15.81 | -16.02 | 0 | 7 | 0 | 82 | 512.606 | 9 | ↓ |
Mid Mid (pH 6-8) | 6.08 | 16.19 | -33.69 | 1 | 7 | 1 | 83 | 513.614 | 9 | ↓ |