In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2011 | 19 | Yes |
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) | 2.83 | 5.78 | -4.69 | 2 | 2 | 0 | 32 | 253.345 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.83 | 6.75 | -41.04 | 3 | 2 | 1 | 37 | 254.353 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.