UCSF

ZINC40080377

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2010 37 No

Popular Name: (2S)-1-butyl-2-(3,5-ditert-butyl-4-hydroxy-phenyl)-4-hydroxy-3-(4-methoxy-2-methyl-benzoyl)-2H-pyrro (2S)-1-butyl-2-(3,5-ditert-butyl…

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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) 7.30 12.4 -45.18 1 6 -1 90 506.663 9 ↓
Lo Low (pH 4.5-6) 7.30 11.64 -8.96 2 6 0 87 507.671 9 ↓

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