UCSF

ZINC62956734

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 20th, 2011 21 Yes

Popular Name: 2-[(4-ethyl-4-methyl-1-piperidyl)methyl]-N-methyl-thieno[2,3-d]pyrimidin-4-amine 2-[(4-ethyl-4-methyl-1-piperidyl…

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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) 3.08 8.36 -33.24 2 4 1 42 305.471 4 ↓
Hi High (pH 8-9.5) 3.08 6.1 -8.24 1 4 0 41 304.463 4 ↓

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

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