In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 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) | 0.65 | -2.67 | -7.89 | 4 | 5 | 0 | 101 | 185.19 | 0 | ↓ |
Mid Mid (pH 6-8) | 0.65 | -2.49 | -31.13 | 5 | 5 | 1 | 102 | 186.198 | 0 | ↓ |
Mid Mid (pH 6-8) | 0.65 | -2.46 | -29.77 | 5 | 5 | 1 | 102 | 186.198 | 0 | ↓ |