In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 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) | 1.34 | 5.01 | -11.95 | 0 | 4 | 0 | 34 | 258.321 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.34 | 7.29 | -45.27 | 1 | 4 | 1 | 36 | 259.329 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.