In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 14 | 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) | 0.00 | 1.13 | -46.7 | 3 | 4 | 1 | 57 | 201.29 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.00 | 0.8 | -9.61 | 2 | 4 | 0 | 56 | 200.282 | 3 | ↓ |