In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 17th, 2005 | 22 | 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) | 2.87 | 8.49 | -15.22 | 1 | 4 | 0 | 47 | 293.37 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.87 | 8.9 | -36.58 | 2 | 4 | 1 | 48 | 294.378 | 5 | ↓ |