UCSF

ZINC12951968

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 23rd, 2008 35 No

Popular Name: methyl 1-benzyl-3-(4-methoxyphenyl)-4,6-dioxo-5-phenyloctahydropyrrolo[3,4-c]pyrrole-1-carboxylate methyl 1-benzyl-3-(4-methoxyphen…

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CAS Number: 318239-69-9

Other Names:

MFCD00202518

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) 4.29 10.74 -12.06 1 7 0 85 470.525 7 ↓
Mid Mid (pH 6-8) 4.29 11.68 -48.41 2 7 1 90 471.533 7 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 212 - 214 KeyOrganics

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