In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 14 | 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) | -1.79 | -4.38 | -42.4 | 3 | 8 | -1 | 119 | 195.162 | 0 | ↓ |
Lo Low (pH 4.5-6) | -1.79 | -4.23 | -41.9 | 4 | 8 | 0 | 120 | 196.17 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.