UCSF

ZINC55068754

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2010 20 Yes

Popular Name: [6-[4-[(1R)-1-methylpropyl]piperazin-1-yl]imidazo[2,1-b]thiazol-5-yl]methanamine [6-[4-[(1R)-1-methylpropyl]piper…

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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) 1.79 7.18 -105.87 4 5 2 53 295.456 4 ↓
Hi High (pH 8-9.5) 1.79 4.93 -9.25 2 5 0 50 293.44 4 ↓
Hi High (pH 8-9.5) 1.79 5.36 -53.66 3 5 1 51 294.448 4 ↓

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

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