UCSF

ZINC62955169

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 20th, 2011 21 Yes

Popular Name: 1-[6-(4,4-diethyl-1-piperidyl)imidazo[2,1-b]thiazol-5-yl]-N-methyl-methanamine 1-[6-(4,4-diethyl-1-piperidyl)im…

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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) 3.29 9.7 -112.15 3 4 2 38 308.495 5 ↓
Hi High (pH 8-9.5) 3.29 7.86 -8.43 1 4 0 33 306.479 5 ↓
Mid Mid (pH 6-8) 3.29 9.31 -48.8 2 4 1 37 307.487 5 ↓

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

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