UCSF

ZINC01382758

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 24 No

Popular Name: 1-(2-chloroacetyl)-9b-(4-chlorophenyl)-1,2,3,9b-tetrahydro-5H-imidazo[2,1-a]isoindol-5-one 1-(2-chloroacetyl)-9b-(4-chlorop…

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CAS Number: 27269-37-0

Other Names:

MFCD02083223

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) 3.30 8.67 -13.12 0 4 0 41 361.228 2 ↓

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.