UCSF

ZINC20000401

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2008 25 Yes

Popular Name: 2-[(3-cyano-6-methyl-5,6,7,8-tetrahydro[1,6]naphthyridin-2-yl)sulfanyl]-N-(4-fluorophenyl)acetamide 2-[(3-cyano-6-methyl-5,6,7,8-tet…

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CAS Number: 496018-60-1

Other Names:

MFCD02950134

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) 2.54 6.27 -13.86 1 5 0 69 356.426 4 ↓

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

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