UCSF

ZINC67947669

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2011 17 Yes

Popular Name: 5-(3,8-diazaspiro[4.5]decan-3-ylmethyl)-2-methyl-thiazole 5-(3,8-diazaspiro[4.5]decan-3-yl…

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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) 0.66 3.55 -42.98 2 3 1 33 252.407 2 ↓
Mid Mid (pH 6-8) 0.66 6.06 -98.86 3 3 2 34 253.415 2 ↓

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Rings

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

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