In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 27th, 2011 | 26 | 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) | 0.12 | 5.59 | -57.81 | 4 | 8 | 1 | 101 | 356.406 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.12 | 5.12 | -31.44 | 3 | 8 | 0 | 99 | 355.398 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.