In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 20th, 2011 | 14 | No |
None
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) | -1.56 | 7 | -28.23 | 1 | 2 | 1 | 16 | 185.25 | 2 | ↓ |
Hi High (pH 8-9.5) | -1.56 | 6.55 | -19.53 | 0 | 2 | 0 | 18 | 184.242 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.