UCSF

ZINC53335617

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2010 16 Yes

Popular Name: 2-(3-chlorophenyl)-4H,5H,6H,7H-[1,3]thiazolo[5,4-c]pyridine 2-(3-chlorophenyl)-4H,5H,6H,7H-[…

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CAS Number: 1251128-06-9

Other Names:

MFCD16794799

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) 3.52 6.15 -46.06 2 2 1 29 251.762 1 ↓
Mid Mid (pH 6-8) 3.52 4.79 -6.55 1 2 0 25 250.754 1 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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Rings

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

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