UCSF

ZINC36159397

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 29 Yes

Popular Name: 2-[[[(2R)-3-allyloxy-2-hydroxy-propyl]-isopentyl-amino]methyl]-5,6,7,8-tetrahydro-3H-benzothiopheno[ 2-[[[(2R)-3-allyloxy-2-hydroxy-p…

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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) 3.47 8.8 -53.25 3 6 1 80 420.599 11 ↓
Hi High (pH 8-9.5) 3.92 6.49 -42.55 2 6 0 83 419.591 11 ↓
Hi High (pH 8-9.5) 3.47 6.47 -15.19 2 6 0 78 419.591 11 ↓

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