In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2009 | 31 | 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) | 3.83 | 8.66 | -59.77 | 1 | 6 | -1 | 93 | 427.461 | 3 | ↓ |
Ref Reference (pH 7) | 3.64 | 11.23 | -53.35 | 1 | 6 | -1 | 90 | 427.461 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.