UCSF

ZINC01383348

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 26 Yes

Popular Name: morpholino[3-(2-thienyl)-6-(trifluoromethyl)thieno[3,2-b]pyridin-2-yl]methanone morpholino[3-(2-thienyl)-6-(trif…

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CAS Number: 477845-24-2

Other Names:

MFCD01314984

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) 3.91 -0.68 -10.85 0 4 0 42 398.431 3 ↓
Lo Low (pH 4.5-6) 3.91 -0.58 -36.81 1 4 1 43 399.439 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 104 - 107 KeyOrganics

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Rings

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

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