In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 14 | 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) | 1.32 | 6.09 | -81.78 | 3 | 3 | 2 | 31 | 193.294 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.32 | 5.62 | -39.23 | 2 | 3 | 1 | 29 | 192.286 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.