In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 21 | No |
None
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) | 1.60 | 8.77 | -6.69 | 0 | 5 | 0 | 41 | 326.491 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.60 | 10.54 | -32.51 | 1 | 5 | 1 | 43 | 327.499 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.