UCSF

ZINC00710217

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2005 27 Yes

Popular Name: ethyl 2-{[3-(1-azepanyl)propanoyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate ethyl 2-{[3-(1-azepanyl)propanoy…

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Other Names:

MFCD02328891

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) 4.40 0.22 -45.41 2 5 1 59 393.573 7 ↓

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