In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 22nd, 2008 | 16 | Yes |
None
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) | 0.14 | 2.75 | -57.32 | 2 | 4 | 1 | 49 | 236.32 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.14 | 1.54 | -30.46 | 2 | 4 | 1 | 46 | 236.32 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.14 | 1.35 | -15.8 | 1 | 4 | 0 | 45 | 235.312 | 1 | ↓ |