UCSF

ZINC71514766

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2011 28 Yes

Popular Name: (2R)-2-methyl-6-[(2S)-2-[(6-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]propanoyl]-4H-1,4-b (2R)-2-methyl-6-[(2S)-2-[(6-meth…

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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) 3.80 4.72 -47.69 1 7 -1 104 414.488 4 ↓
Mid Mid (pH 6-8) 3.34 6.48 -15.8 2 7 0 101 415.496 4 ↓

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

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