UCSF

ZINC03379383

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2004 18 No

Popular Name: 2-Chloro-1-[4-(4-methoxy-phenyl)-piperazin-1-yl]-ethanone 2-Chloro-1-[4-(4-methoxy-phenyl)…

Find On: PubMed — Wikipedia — Google

CAS Numbers: , 1170155-87-9 , 92513-17-2 , [92513-17-2]

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) 1.92 -1.79 -11.2 0 4 0 32 268.744 3 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks
MP 93 - 95 Enamine Building Blocks
MP 93...95 Enamine Building Blocks
MP 94 - 95 Enamine Building Blocks
purity 95 Enamine Building Blocks
MP 95 - 95 Enamine Building Blocks
MP 95 - 97 Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

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