In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 23rd, 2006 | 27 | No |
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) | -0.28 | 11.71 | -27.76 | 1 | 3 | 1 | 18 | 360.525 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.28 | 12.51 | -50.77 | 2 | 3 | 0 | 19 | 361.533 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.