UCSF

ZINC67514566

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2011 25 Yes

Popular Name: (3S)-3-hydroxy-1-(2-methoxyethyl)-3-[[methyl(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)amino]meth (3S)-3-hydroxy-1-(2-methoxyethyl…

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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) 0.80 6.39 -42.49 2 7 1 80 352.455 7 ↓
Mid Mid (pH 6-8) 0.80 4.35 -13.03 1 7 0 79 351.447 7 ↓

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

No pre-computed analogs available. Try a structural similarity search.