In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2009 | 19 | 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) | 1.09 | 3.54 | -41.91 | 2 | 5 | 1 | 73 | 278.357 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.09 | 3.44 | -17.21 | 1 | 5 | 0 | 72 | 277.349 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.