UCSF

ZINC62959169

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 20th, 2011 19 Yes

Popular Name: 2-(8-azaspiro[4.5]decan-8-yl)-4-methyl-thiazole-5-carboxylic 2-(8-azaspiro[4.5]decan-8-yl)-4-…

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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) 3.01 8.75 -50.19 0 4 -1 56 279.385 2 ↓
Mid Mid (pH 6-8) 3.01 9.13 -38.21 1 4 0 58 280.393 2 ↓

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

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