In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 18 | 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) | 0.34 | 2.92 | -18.23 | 2 | 5 | 0 | 78 | 265.338 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.34 | 3.41 | -43.77 | 3 | 5 | 1 | 79 | 266.346 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.