UCSF

ZINC19837677

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2008 31 Yes

Popular Name: [5-[[(2S)-2-(2-morpholinoethyl)-1-piperidyl]methyl]imidazo[2,1-b]thiazol-6-yl]-(1-piperidyl)methanon [5-[[(2S)-2-(2-morpholinoethyl)-…

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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) 2.71 8.17 -10.94 0 7 0 53 445.633 6 ↓
Mid Mid (pH 6-8) 2.71 10.44 -41.23 1 7 1 55 446.641 6 ↓
Lo Low (pH 4.5-6) 2.71 12.61 -103.58 2 7 2 56 447.649 6 ↓

Activity (Go SEA)

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