UCSF

ZINC41198193

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Substance Information

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

Popular Name: N-[(S)-(3-fluorophenyl)-thiazol-2-yl-methyl]cyclopropanamine N-[(S)-(3-fluorophenyl)-thiazol-…

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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) 2.44 6.83 -35.81 2 2 1 29 249.334 4 ↓
Mid Mid (pH 6-8) 2.44 5.49 -4.74 1 2 0 25 248.326 4 ↓

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