In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 16 | 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) | 3.03 | 5.73 | -10.97 | 1 | 2 | 0 | 37 | 266.778 | 1 | ↓ |
Mid Mid (pH 6-8) | 4.12 | 5.75 | -7.6 | 2 | 2 | 0 | 39 | 266.778 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.