UCSF

ZINC57279656

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 18th, 2011 20 Yes

Popular Name: 3-[(5-tert-butyloxazol-2-yl)methylsulfanyl]-6-ethyl-1,2,4-triazin-5-ol 3-[(5-tert-butyloxazol-2-yl)meth…

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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) 3.38 1.2 -42.89 0 6 -1 88 293.372 5 ↓
Lo Low (pH 4.5-6) 2.92 2.7 -10.91 1 6 0 85 294.38 5 ↓

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

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