In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 38 | 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) | -6.21 | -15.78 | -284.92 | 5 | 21 | -4 | 351 | 619.51 | 12 | ↓ |
Hi High (pH 8-9.5) | -6.21 | -16.08 | -442.67 | 4 | 21 | -5 | 353 | 618.502 | 12 | ↓ |
No pre-computed analogs available. Try a structural similarity search.