UCSF

ZINC55420618

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 14th, 2010 18 Yes

Popular Name: 2-[(4-hydroxy-1-piperidyl)methyl]-3H-thieno[3,2-d]pyrimidin-4-one 2-[(4-hydroxy-1-piperidyl)methyl…

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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) 0.14 0.33 -49.03 2 5 0 74 265.338 2 ↓
Mid Mid (pH 6-8) -0.32 2.97 -52.82 3 5 1 70 266.346 2 ↓

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

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