UCSF

ZINC52875691

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2010 22 Yes

Popular Name: 2-ethyl-7-[(2-methylsulfanylanilino)methyl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one 2-ethyl-7-[(2-methylsulfanylanil…

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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) 2.62 7.11 -15.53 1 5 0 59 332.454 5 ↓
Lo Low (pH 4.5-6) 2.62 7.53 -38.2 2 5 1 61 333.462 5 ↓

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

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