In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2011 | 35 | 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) | 2.84 | 11.07 | -18.87 | 2 | 10 | 0 | 112 | 479.537 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.84 | 11.37 | -41.1 | 3 | 10 | 1 | 114 | 480.545 | 6 | ↓ |