UCSF

ZINC19441622

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2008 20 Yes

Popular Name: 1-[(benzyloxy)carbonyl]-4-methoxypyrrolidine-2-carboxylic acid 1-[(benzyloxy)carbonyl]-4-methox…

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Other Names:

MFCD09934785

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) -0.33 5.7 -59.79 0 6 -1 79 278.284 5 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
PUBCHEM_PATENT_ID US5886008 IBM Patent Data

Activity (Go SEA)

Rings

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

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