UCSF

ZINC41674329

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 16 Yes

Popular Name: (S)-5,6-dihydro-4H-cyclopenta[d]thiazol-2-yl-(3-methyl-2-thienyl)methanamine (S)-5,6-dihydro-4H-cyclopenta[d]…

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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) 2.81 4.71 -6.37 2 2 0 39 250.392 2 ↓
Mid Mid (pH 6-8) 2.81 5.04 -38.7 3 2 1 41 251.4 2 ↓

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Rings

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

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