In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2006 | 10 | 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) | 0.91 | 1.5 | -13.36 | 1 | 4 | 0 | 47 | 204.027 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.09 | 1.8 | -4.64 | 1 | 4 | 0 | 50 | 204.027 | 2 | ↓ |