In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2011 | 16 | 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) | -0.69 | 1.47 | -53.76 | 2 | 5 | 1 | 59 | 222.268 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.69 | 0.14 | -12.79 | 1 | 5 | 0 | 54 | 221.26 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.