UCSF

ZINC41636038

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 23 Yes

Popular Name: 5-[(R)-(2,6-dichlorophenyl)-[2-hydroxyethyl(methyl)amino]methyl]thiazolo[2,3-e][1,2,4]triazol-6-ol 5-[(R)-(2,6-dichlorophenyl)-[2-h…

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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) 2.86 5.37 -37.97 2 6 0 78 373.265 5 ↓
Hi High (pH 8-9.5) 2.86 4.29 -47.91 1 6 -1 77 372.257 5 ↓
Mid Mid (pH 6-8) 2.86 3.79 -8.99 2 6 0 74 373.265 5 ↓
Lo Low (pH 4.5-6) 2.86 4.66 -32.72 3 6 1 75 374.273 5 ↓

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

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