In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 10th, 2011 | 34 | No |
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) | -3.85 | -1.4 | -151.73 | 3 | 16 | -2 | 239 | 528.3 | 8 | ↓ |
Hi High (pH 8-9.5) | -3.85 | -2.12 | -218.9 | 2 | 16 | -3 | 242 | 527.292 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.