In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 20 | 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) | 2.64 | 8.32 | -44.37 | 3 | 2 | 1 | 41 | 283.42 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.64 | 8 | -7.85 | 2 | 2 | 0 | 39 | 282.412 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.