UCSF

ZINC42463891

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 29th, 2010 17 Yes

Popular Name: (2R)-1-(cyclopropylamino)-3-[methyl-[[(2R)-tetrahydropyran-2-yl]methyl]amino]propan-2-ol (2R)-1-(cyclopropylamino)-3-[met…

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Download: MOL2 SDF SMILES Flexibase

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) 0.73 1.33 -37.21 3 4 1 49 243.371 7 ↓
Mid Mid (pH 6-8) 0.73 4.33 -40.92 3 4 1 53 243.371 7 ↓

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