UCSF

ZINC36158720

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 30 Yes

Popular Name: 2-[[[(2S)-3-tert-butoxy-2-hydroxy-propyl]-isopentyl-amino]methyl]-5,6,7,8-tetrahydro-3H-benzothiophe 2-[[[(2S)-3-tert-butoxy-2-hydrox…

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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) 4.01 9.58 -54.63 3 6 1 80 436.642 10 ↓
Hi High (pH 8-9.5) 4.46 6.95 -48.1 2 6 0 83 435.634 10 ↓
Hi High (pH 8-9.5) 4.01 7.29 -13.21 2 6 0 78 435.634 10 ↓

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