In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 25th, 2010 | 24 | 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) | 3.38 | 5.65 | -15.71 | 2 | 5 | 0 | 71 | 347.484 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.38 | 6.29 | -32.46 | 3 | 5 | 1 | 72 | 348.492 | 5 | ↓ |