In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 17 | 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) | 0.06 | 0.74 | -39.48 | 3 | 6 | 1 | 81 | 257.339 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.06 | 0.28 | -13.62 | 2 | 6 | 0 | 80 | 256.331 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.