In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 23rd, 2009 | 34 | 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) | 1.70 | 5.97 | -19.95 | 1 | 10 | 0 | 114 | 483.55 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.70 | 6.36 | -38.27 | 2 | 10 | 1 | 115 | 484.558 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.