UCSF

ZINC33509799

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 11th, 2009 34 No

Popular Name: (2R)-1-(2-dimethylaminoethyl)-2-(3-ethoxy-4-isopentyloxy-phenyl)-4-hydroxy-3-(thiophene-2-carbonyl)- (2R)-1-(2-dimethylaminoethyl)-2-…

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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) 3.98 12.01 -78.51 1 7 0 83 486.634 12 ↓
Hi High (pH 8-9.5) 3.98 9.48 -58.46 0 7 -1 82 485.626 12 ↓
Lo Low (pH 4.5-6) 3.98 11.06 -55.32 2 7 1 81 487.642 12 ↓

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