UCSF

ZINC20057965

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2008 37 No

Popular Name: (5R)-4-(4-benzyloxy-3-methyl-benzoyl)-1-(2-dimethylaminoethyl)-5-(4-ethylphenyl)-3-hydroxy-5H-pyrrol (5R)-4-(4-benzyloxy-3-methyl-ben…

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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) 5.35 14.94 -71.17 1 6 0 74 498.623 10 ↓
Hi High (pH 8-9.5) 5.35 12.4 -60.4 0 6 -1 73 497.615 10 ↓
Lo Low (pH 4.5-6) 5.35 14.13 -50.52 2 6 1 71 499.631 10 ↓

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