In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2010 | 27 | Yes |
None
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) | 1.57 | 7.43 | -15.75 | 1 | 6 | 0 | 76 | 391.399 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.71 | 6.54 | -51.33 | 0 | 6 | -1 | 80 | 390.391 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.