In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2014 | 67 | 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) | 5.25 | 12.9 | -39.54 | 6 | 15 | 1 | 188 | 947.144 | 14 | ↓ |
Mid Mid (pH 6-8) | 5.25 | 15.49 | -99.43 | 7 | 15 | 2 | 189 | 948.152 | 14 | ↓ |
No pre-computed analogs available. Try a structural similarity search.