UCSF

ZINC15020721

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2008 14 Yes

Popular Name: 4-((4-Chlorophenyl)thio)piperidine hydrochloride 4-((4-Chlorophenyl)thio)piperidi…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 101768-63-2 , 101798-64-5

Download: MOL2 SDF SMILES Flexibase

Physical Representations

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) 2.87 6.95 -44.47 2 1 1 17 228.768 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 41 - 43 Enamine Building Blocks
MP 41...43 Enamine Building Blocks
MP 43 - 45 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.