In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 8th, 2011 | 26 | No |
None
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) | 2.86 | 14.19 | -61.92 | 1 | 5 | 1 | 40 | 372.493 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.86 | 12.65 | -24.78 | 0 | 5 | 0 | 38 | 371.485 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.