In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 39 | Yes |
None
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) | 5.60 | 12.64 | -20.39 | 0 | 8 | 0 | 91 | 525.557 | 7 | ↓ |
Mid Mid (pH 6-8) | 5.60 | 15.47 | -57.53 | 1 | 8 | 1 | 93 | 526.565 | 7 | ↓ |