In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 17 | 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) | 3.02 | 6.43 | -25.5 | 3 | 3 | 1 | 43 | 234.367 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.02 | 6.11 | -4.49 | 2 | 3 | 0 | 42 | 233.359 | 3 | ↓ |