UCSF

ZINC12404917

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 13th, 2008 18 Yes

Popular Name: methyl 6-methylthieno[2,3-b]quinoline-2-carboxylate methyl 6-methylthieno[2,3-b]quin…

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CAS Number: 918145-25-2

Other Names:

MFCD09832491

QA-8881

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) 3.72 0.64 -9.38 0 3 0 39 257.314 2 ↓
Lo Low (pH 4.5-6) 3.72 0.7 -29.48 1 3 1 40 258.322 2 ↓

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

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