UCSF

ZINC21993886

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2008 24 Yes

Popular Name: tert-Butyl 4-(4-(ethoxycarbonyl)phenyl)piperazine-1-carboxylate tert-Butyl 4-(4-(ethoxycarbonyl)…

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CAS Number: 234082-33-8

Other Names:

MFCD09031688

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) 3.51 8.04 -9.59 0 6 0 59 334.416 6 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP1057818A1 IBM Patent Data

Activity (Go SEA)

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