In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 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) | 0.94 | 2.44 | -39.42 | 3 | 6 | 1 | 81 | 285.393 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.94 | 1.97 | -13 | 2 | 6 | 0 | 80 | 284.385 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.