In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2009 | 15 | 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) | 1.42 | 4.05 | -5.97 | 2 | 2 | 0 | 28 | 204.248 | 0 | ↓ |
Mid Mid (pH 6-8) | 1.42 | 5.34 | -46.6 | 3 | 2 | 1 | 32 | 205.256 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.