In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 27 | 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) | 3.98 | 2.3 | -16.85 | 3 | 6 | 0 | 91 | 406.269 | 5 | ↓ |
Ref Reference (pH 7) | 3.80 | 4.95 | -18.18 | 3 | 6 | 0 | 87 | 406.269 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.