UCSF

ZINC11536105

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 18th, 2008 18 No

Popular Name: 2-hydroxy-N-[2-hydroxy-1-(hydroxymethyl)-1-methylethyl]-4-methyl-6-sulfanyl-5-pyrimidinecarboxamide 2-hydroxy-N-[2-hydroxy-1-(hydrox…

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Other Names:

MFCD02942638

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) -1.37 -6.65 -54.35 4 7 -1 121 272.306 4 ↓
Lo Low (pH 4.5-6) -1.82 -4.73 -22.58 5 7 0 118 273.314 4 ↓

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Rings

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

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