In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2010 | 18 | 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) | -0.85 | -2.37 | -8.58 | 3 | 7 | 0 | 93 | 251.29 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.85 | -0.1 | -42.49 | 4 | 7 | 1 | 95 | 252.298 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.