In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2008 | 17 | Yes |
None
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) | 0.50 | 4.16 | -37.3 | 2 | 4 | 1 | 37 | 240.371 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.50 | 5.53 | -95.85 | 3 | 4 | 2 | 41 | 241.379 | 3 | ↓ |