UCSF

ZINC52880021

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2010 21 Yes

Popular Name: (2R)-2-phenyl-2-(thieno[3,2-d]pyrimidin-4-ylamino)propanoic (2R)-2-phenyl-2-(thieno[3,2-d]py…

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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) 2.55 8.98 -54.89 1 5 -1 78 298.347 4 ↓
Lo Low (pH 4.5-6) 2.55 9.44 -45.42 2 5 0 79 299.355 4 ↓

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

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