UCSF

ZINC40101279

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2010 33 No

Popular Name: (2S)-4-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-2-(4-methylsulfanylphenyl)-3-(3-propoxybenzoyl)-2H-pyrro (2S)-4-hydroxy-1-[2-(2-hydroxyet…

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Annotations

Vendors

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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) 2.98 7.57 -66.54 1 7 -1 99 470.567 12 ↓
Lo Low (pH 4.5-6) 2.98 6.82 -19.59 2 7 0 96 471.575 12 ↓

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