In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2010 | 18 | 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) | 1.38 | 4.45 | -41.37 | 2 | 4 | 1 | 40 | 254.398 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.38 | 3.08 | -7.51 | 1 | 4 | 0 | 36 | 253.39 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.