UCSF

ZINC32964501

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 14th, 2009 29 No

Popular Name: (Z)-6-((1-(2,6-dimethylphenyl)-1H-pyrrol-2-yl)methylene)-5-imino-3-(methylsulfonyl)-5H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7(6H)-one (Z)-6-((1-(2,6-dimethylphenyl)-1…

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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) 1.64 7.27 -16.24 1 8 0 110 427.511 3 ↓
Lo Low (pH 4.5-6) 1.64 7.26 -98.97 3 8 2 113 429.527 3 ↓

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

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