In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2010 | 21 | 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) | 1.62 | 3.86 | -13.7 | 2 | 6 | 0 | 88 | 302.359 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.62 | 3.84 | -44.36 | 1 | 6 | -1 | 90 | 301.351 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.