UCSF

ZINC36156798

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 31 Yes

Popular Name: 2-[[[(2S)-3-(2-furylmethoxy)-2-hydroxy-propyl]-isobutyl-amino]methyl]-5,6,7,8-tetrahydro-3H-benzothi 2-[[[(2S)-3-(2-furylmethoxy)-2-h…

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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) 3.14 8.32 -57.02 3 7 1 93 446.593 10 ↓
Hi High (pH 8-9.5) 3.60 6.08 -52.08 2 7 0 96 445.585 10 ↓
Hi High (pH 8-9.5) 3.14 7.04 -16.94 2 7 0 92 445.585 10 ↓

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