UCSF

ZINC57981668

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2011 27 Yes

Popular Name: (2S)-2-(2,2-dimethylpropyl)-N-[4-(ethylsulfonylamino)-3-methoxy-phenyl]pyrrolidine-1-carboxamide (2S)-2-(2,2-dimethylpropyl)-N-[4…

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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) 3.65 5.32 -57.93 1 7 -1 90 396.533 7 ↓
Mid Mid (pH 6-8) 3.65 5.24 -16.78 2 7 0 88 397.541 7 ↓

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

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