| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 12th, 2013 | 12 | No |
Popular Name: 4-CHLOROBENZYL 2-HYDROXYETHYL SULFIDE 4-CHLOROBENZYL 2-HYDROXYETHYL SU…
Find On: PubMed — Wikipedia — Google
CAS Number: 71501-40-1
| 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) | 2.47 | 3.95 | -3.4 | 1 | 1 | 0 | 20 | 202.706 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.47 | 4.49 | -38.86 | 1 | 1 | -1 | 20 | 201.698 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.