UCSF

ZINC33754207

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2009 32 Yes

Popular Name: LS-157325; Triethylamine, 2,2'''-((dimethylvinylene)bis(p-phenyleneoxy))bis-, (E)-; trans-2,2'''-((Dimethylvinylene)bis(p-phenyleneoxy))bis(triethylamine) LS-157325; Triethylamine, 2,2'''…

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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) 5.93 16.56 -72.43 2 4 2 27 440.672 14 ↓
Hi High (pH 8-9.5) 5.93 14.07 -35.88 1 4 1 26 439.664 14 ↓
Hi High (pH 8-9.5) 5.93 11.8 -4.55 0 4 0 25 438.656 14 ↓

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