In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 20 | 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) | 1.85 | 6.04 | -44.42 | 3 | 4 | 1 | 57 | 279.404 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.85 | 5.74 | -7.41 | 2 | 4 | 0 | 56 | 278.396 | 9 | ↓ |