In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2010 | 14 | 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) | 1.27 | 6.56 | -49.93 | 2 | 3 | 1 | 34 | 194.302 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.27 | 7.04 | -97.8 | 3 | 3 | 2 | 36 | 195.31 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.