UCSF

ZINC69951719

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2011 23 Yes

Popular Name: N-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-yl)-2-[(3R)-3-hydroxy-3-(trifluoromethyl)-1-piperidyl]aceta N-(5,6-dihydro-4H-cyclopenta[d]t…

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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) 2.29 5.17 -47.05 3 5 1 67 350.386 4 ↓
Hi High (pH 8-9.5) 2.29 2.93 -16.23 2 5 0 65 349.378 4 ↓
Hi High (pH 8-9.5) 2.29 3.45 -55.76 1 5 -1 68 348.37 4 ↓

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

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