In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 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) | 1.19 | 3.46 | -33.57 | 1 | 3 | 1 | 20 | 199.318 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.19 | 1.49 | -3.72 | 0 | 3 | 0 | 19 | 198.31 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.