In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2008 | 34 | 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) | 4.75 | 12.96 | -49.94 | 3 | 6 | 1 | 76 | 477.654 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.75 | 11.13 | -13.27 | 2 | 6 | 0 | 74 | 476.646 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.