UCSF

ZINC40093654

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2010 39 No

Popular Name: (2S)-1-butyl-2-(3-ethoxy-4-isopentyloxy-phenyl)-4-hydroxy-3-(4-isopropoxy-3-methyl-benzoyl)-2H-pyrro (2S)-1-butyl-2-(3-ethoxy-4-isope…

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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) 6.66 14.35 -59.65 0 7 -1 88 536.689 14 ↓
Lo Low (pH 4.5-6) 6.66 13.6 -15.21 1 7 0 85 537.697 14 ↓

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