UCSF

ZINC53664723

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2010 20 Yes

Popular Name: N-[(1-thieno[3,2-c]pyridin-4-yl-4-piperidyl)methyl]propan-2-amine N-[(1-thieno[3,2-c]pyridin-4-yl-…

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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) 3.27 9.24 -83.36 3 3 2 34 291.464 4 ↓
Hi High (pH 8-9.5) 3.27 8.75 -40.86 2 3 1 33 290.456 4 ↓

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

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