In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 23rd, 2008 | 37 | 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) | 4.34 | 10.84 | -25.46 | 0 | 7 | 0 | 76 | 508.965 | 1 | ↓ |
Mid Mid (pH 6-8) | 4.34 | 13.75 | -42.62 | 1 | 7 | 1 | 77 | 509.973 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.