In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2008 | 19 | 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) | -0.34 | 0.64 | -15.13 | 2 | 5 | 0 | 65 | 257.293 | 1 | ↓ |
Mid Mid (pH 6-8) | -0.34 | 2.01 | -57.4 | 3 | 5 | 1 | 70 | 258.301 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.