In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2010 | 10 | 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) | 0.40 | 3.69 | -124.68 | 0 | 3 | -2 | 63 | 142.154 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.40 | 2.14 | -41.68 | 1 | 3 | -1 | 60 | 143.162 | 2 | ↓ |