UCSF

ZINC55080302

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2010 21 Yes

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

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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) 2.07 9.45 -100.78 3 5 2 42 309.483 5 ↓
Hi High (pH 8-9.5) 2.07 7.52 -48.3 2 5 1 40 308.475 5 ↓
Hi High (pH 8-9.5) 2.07 6.05 -8.61 1 5 0 36 307.467 5 ↓

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

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