UCSF

ZINC41678466

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Substance Information

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

Popular Name: N-[(R)-(4-bromo-2-thienyl)-thiazol-2-yl-methyl]cyclopropanamine N-[(R)-(4-bromo-2-thienyl)-thiaz…

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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) 2.94 5.24 -4.93 1 2 0 25 315.261 4 ↓
Mid Mid (pH 6-8) 2.94 6.4 -33.41 2 2 1 29 316.269 4 ↓

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

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