UCSF

ZINC17823343

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2008 31 No

Popular Name: 2-(4-chlorophenyl)-2-oxoethyl 3-(4-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)benzoate 2-(4-chlorophenyl)-2-oxoethyl 3-…

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Other Names:

MFCD01798827

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) 4.17 13.55 -13.29 0 6 0 81 437.879 6 ↓
Ref Reference (pH 7) 4.17 13.28 -12.06 0 6 0 81 437.879 6 ↓

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

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