In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2011 | 26 | 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) | -0.66 | 3.28 | -20.4 | 0 | 8 | 0 | 75 | 360.414 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.66 | 5.54 | -57.29 | 1 | 8 | 1 | 76 | 361.422 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.