In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2011 | 19 | Yes |
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) | 0.91 | 2.92 | -8.37 | 3 | 4 | 0 | 68 | 263.247 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.91 | 3.38 | -42.33 | 4 | 4 | 1 | 69 | 264.255 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.