UCSF

ZINC69498548

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2011 18 Yes

Popular Name: (1R)-N-ethyl-1-(1-ethylimidazol-2-yl)-2-(4-methylthiazol-2-yl)ethanamine (1R)-N-ethyl-1-(1-ethylimidazol-…

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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) 1.28 5.61 -29.97 2 4 1 44 265.406 6 ↓
Mid Mid (pH 6-8) 1.28 6.23 -31.77 2 4 1 47 265.406 6 ↓
Mid Mid (pH 6-8) 1.28 5.44 -6.47 1 4 0 43 264.398 6 ↓

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

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