UCSF

ZINC22996820

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 23rd, 2008 16 Yes

Popular Name: 1-[3-(methylsulfonyl)phenyl]tetrahydro-2H-imidazol-2-one 1-[3-(methylsulfonyl)phenyl]tetr…

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CAS Number: 1092346-63-8

Other Names:

MFCD11501863

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) 0.05 0.72 -18.6 1 5 0 66 240.284 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 196 - 198 KeyOrganics

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Rings

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

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