UCSF

ZINC53664108

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2010 18 Yes

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

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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) 2.59 7.86 -84.06 3 3 2 34 263.41 3 ↓
Hi High (pH 8-9.5) 2.59 7.37 -43.08 2 3 1 33 262.402 3 ↓

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

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