UCSF

ZINC40028119

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2010 32 No

Popular Name: (2S)-1-allyl-3-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-4-hydroxy-2-(3-propoxyphenyl)-2H-pyrrol-5-o (2S)-1-allyl-3-(2,3-dihydro-1,4-…

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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) 3.44 9.22 -58.96 0 7 -1 88 434.468 8 ↓
Lo Low (pH 4.5-6) 3.44 8.47 -14.46 1 7 0 85 435.476 8 ↓

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