In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 27th, 2011 | 40 | No |
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) | -0.84 | 4.76 | -92.86 | 4 | 16 | 0 | 211 | 607.704 | 13 | ↓ |
Mid Mid (pH 6-8) | -0.84 | 2.29 | -68.41 | 3 | 16 | -1 | 210 | 606.696 | 13 | ↓ |
No pre-computed analogs available. Try a structural similarity search.