In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 21st, 2006 | 18 | 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) | 1.99 | 7.65 | -10.56 | 1 | 3 | 0 | 38 | 238.29 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.99 | 8.16 | -37.27 | 2 | 3 | 1 | 39 | 239.298 | 3 | ↓ |