In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 8th, 2011 | 29 | 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) | 1.36 | 3.13 | -41.25 | 4 | 8 | 1 | 97 | 418.543 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.