UCSF

ZINC36754837

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2009 20 Yes

Popular Name: 2-[(4-amino-1-piperidyl)methyl]-5,6-dimethyl-1H-thieno[2,3-d]pyrimidin-4-one 2-[(4-amino-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) 0.52 2.82 -51.92 4 5 1 77 293.416 2 ↓
Hi High (pH 8-9.5) 0.97 2.11 -43.71 3 5 0 79 292.408 2 ↓
Lo Low (pH 4.5-6) 0.52 5.05 -124.26 5 5 2 78 294.424 2 ↓

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