UCSF

ZINC13451146

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 19th, 2008 33 No

Popular Name: (5R)-5-(2,4-dimethoxyphenyl)-1-(2-dimethylaminoethyl)-3-hydroxy-4-(4-methoxy-3-methyl-benzoyl)-5H-py (5R)-5-(2,4-dimethoxyphenyl)-1-(…

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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) 2.88 8.78 -74.24 1 8 0 93 454.523 9 ↓
Hi High (pH 8-9.5) 2.88 6.23 -59.87 0 8 -1 91 453.515 9 ↓
Mid Mid (pH 6-8) 3.33 7.65 -56.53 2 8 1 90 455.531 8 ↓

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