In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2010 | 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) | 1.34 | 5.75 | -13.11 | 0 | 4 | 0 | 34 | 262.353 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.34 | 8.01 | -56.09 | 1 | 4 | 1 | 36 | 263.361 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.