UCSF

ZINC01385193

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 18 No

Popular Name: N-(4-chlorobenzoyl)-3-oxo-1-pyrazolidinecarboxamide N-(4-chlorobenzoyl)-3-oxo-1-pyra…

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CAS Number: 320424-49-5

Other Names:

MFCD00215563

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) 1.58 -2.49 -16.56 2 6 0 78 267.672 1 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 171 - 173 KeyOrganics

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Rings

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

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