In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 15 | 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) | 1.43 | 7.9 | -12.18 | 0 | 3 | 0 | 42 | 197.241 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.43 | 8.37 | -38.82 | 1 | 3 | 1 | 43 | 198.249 | 2 | ↓ |