UCSF

ZINC33756168

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2009 28 Yes

Popular Name: 7-(2-(3,4-Dimethoxyphenethylamino)ethyl)theophylline monohydrochloride; LS-149512; Theophylline, 7-(2-(3,4-dimethoxyphenethylamino)ethyl)-, monohydrochloride 7-(2-(3,4-Dimethoxyphenethylamin…

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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) 0.95 8.9 -65.18 2 9 1 97 388.448 8 ↓

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