UCSF

ZINC36156761

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Substance Information

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

Popular Name: 2-[[[(2S)-2-hydroxy-3-isopropoxy-propyl]-(3-methoxypropyl)amino]methyl]-5,6,7,8-tetrahydro-3H-benzot 2-[[[(2S)-2-hydroxy-3-isopropoxy…

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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) 2.16 7.01 -54.96 3 7 1 89 424.587 11 ↓
Hi High (pH 8-9.5) 2.16 4.73 -15.11 2 7 0 88 423.579 11 ↓
Hi High (pH 8-9.5) 2.62 4.3 -48.27 2 7 0 92 423.579 11 ↓

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