UCSF

ZINC42157399

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2010 23 No

Popular Name: 5,7-dimethyl-3-[2-(4-nitrophenyl)ethylsulfanyl]-[1,2,4]triazolo[3,4-f]pyrimidine 5,7-dimethyl-3-[2-(4-nitrophenyl…

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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) 2.85 11.59 -16.56 0 7 0 89 329.385 5 ↓

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

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