In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 13 | 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) | -0.25 | 4.86 | -49.63 | 1 | 3 | 1 | 34 | 177.227 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.25 | 2.37 | -7.5 | 0 | 3 | 0 | 33 | 176.219 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.