In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 13 | No |
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) | -1.93 | -5.34 | -44.85 | 1 | 7 | -1 | 104 | 184.131 | 2 | ↓ |
Mid Mid (pH 6-8) | -2.39 | -2.67 | -13.8 | 2 | 7 | 0 | 101 | 185.139 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.