UCSF

ZINC67240279

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 7th, 2011 28 No

Popular Name: (1R,3R,3aS,6aS)-5-(3-carboxyphenyl)-4,6-dioxo-3-phenyl-2,3,3a,6a-tetrahydro-1H-pyrrolo[3,4-c]pyrrole (1R,3R,3aS,6aS)-5-(3-carboxyphen…

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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) 0.18 8.57 -90.95 2 8 -1 134 379.348 4 ↓
Ref Reference (pH 7) 0.18 9.57 -113.93 2 8 -1 134 379.348 4 ↓
Mid Mid (pH 6-8) 0.18 7.33 -111.85 1 8 -2 130 378.34 4 ↓
Mid Mid (pH 6-8) 0.18 8.31 -139.07 1 8 -2 130 378.34 4 ↓

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Rings

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

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