UCSF

ZINC41219005

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2010 14 Yes

Popular Name: 2-piperazin-1-yl-5,6-dihydro-4H-cyclopenta[d]thiazole 2-piperazin-1-yl-5,6-dihydro-4H-…

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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) 1.36 5.01 -46.96 2 3 1 33 210.326 1 ↓
Hi High (pH 8-9.5) 1.36 3.71 -6.91 1 3 0 28 209.318 1 ↓
Lo Low (pH 4.5-6) 1.36 5.4 -90.69 3 3 2 34 211.334 1 ↓

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Rings

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

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