UCSF

ZINC54788292

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 8th, 2010 16 Yes

Popular Name: 1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-N-(thiazol-5-ylmethyl)methanamine 1-(5,6-dihydro-4H-cyclopenta[b]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) 2.62 6.7 -45.61 2 2 1 29 251.4 4 ↓
Hi High (pH 8-9.5) 2.62 5.34 -6.47 1 2 0 25 250.392 4 ↓

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

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