UCSF

ZINC36161533

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 33 Yes

Popular Name: (7R)-2-[[[(2S)-2-hydroxy-3-phenoxy-propyl]-(3-methoxypropyl)amino]methyl]-7-methyl-5,6,7,8-tetrahydr (7R)-2-[[[(2S)-2-hydroxy-3-pheno…

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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) 3.60 8.98 -58.99 3 7 1 89 472.631 11 ↓
Hi High (pH 8-9.5) 3.60 6.83 -16.52 2 7 0 88 471.623 11 ↓
Hi High (pH 8-9.5) 4.05 6.35 -50.06 2 7 0 92 471.623 11 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )