UCSF

ZINC20262984

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 30 No

Popular Name: (5R)-1-(2-dimethylaminoethyl)-5-(4-ethoxy-3-methoxy-phenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-5H-py (5R)-1-(2-dimethylaminoethyl)-5-…

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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) 2.33 9.03 -82.44 1 7 0 83 430.526 9 ↓
Hi High (pH 8-9.5) 2.33 6.48 -64 0 7 -1 82 429.518 9 ↓
Lo Low (pH 4.5-6) 2.33 8.08 -57.79 2 7 1 81 431.534 9 ↓

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