In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 14 | 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) | -0.35 | 1.99 | -6.4 | 2 | 4 | 0 | 63 | 196.25 | 1 | ↓ |
Mid Mid (pH 6-8) | -0.35 | 2.3 | -54.44 | 3 | 4 | 1 | 65 | 197.258 | 1 | ↓ |