In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 16th, 2008 | 13 | 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) | 1.08 | -0.53 | -7.34 | 0 | 3 | 0 | 28 | 175.235 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.08 | -0.42 | -30.97 | 1 | 3 | 1 | 30 | 176.243 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.