UCSF

ZINC62874698

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 17th, 2011 19 Yes

Popular Name: (3S)-3-methyl-1-thieno[3,2-d]pyrimidin-4-yl-piperidine-3-carboxylic (3S)-3-methyl-1-thieno[3,2-d]pyr…

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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) 1.79 8.25 -50.2 0 5 -1 69 276.341 2 ↓
Lo Low (pH 4.5-6) 1.79 8.71 -55.63 1 5 0 70 277.349 2 ↓

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

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