UCSF

ZINC11813129

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 11th, 2008 26 Yes

Popular Name: (5S)-1-[2-(2-chlorophenyl)ethyl]-5-[2-[(4-fluorophenyl)methylamino]ethyl]pyrrolidin-2-one (5S)-1-[2-(2-chlorophenyl)ethyl]…

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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) 4.11 0.57 -61.72 2 3 1 37 375.895 8 ↓

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Rings

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

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