In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2008 | 27 | 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) | 4.65 | 12.09 | -39.48 | 2 | 4 | 1 | 38 | 365.545 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.65 | 10.34 | -8.91 | 1 | 4 | 0 | 37 | 364.537 | 4 | ↓ |