In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 8th, 2011 | 23 | 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) | 2.13 | 7.98 | -41.47 | 2 | 7 | -1 | 92 | 315.332 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.94 | 8.56 | -17.47 | 3 | 7 | 0 | 86 | 316.34 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.