In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 8th, 2011 | 30 | Yes |
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) | 2.84 | 9.27 | -45.59 | 3 | 7 | 1 | 98 | 408.478 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.