In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2004 | 39 | 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) | -0.01 | 13.85 | -35.63 | 3 | 9 | 1 | 112 | 524.601 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.