UCSF

ZINC34964862

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2009 33 Yes

Popular Name: [(3S,4R)-1-tert-butyl-4-(2,4-difluorophenyl)pyrrolidin-3-yl]-[(3S,4R)-4-hydroxy-3-methyl-4-phenyl-1- [(3S,4R)-1-tert-butyl-4-(2,4-dif…

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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) 4.86 11.67 -50.19 2 4 1 45 457.585 4 ↓
Mid Mid (pH 6-8) 4.86 9.27 -14.14 1 4 0 44 456.577 4 ↓

Activity (Go SEA)

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