UCSF

ZINC70194378

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2011 19 Yes

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

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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) 2.99 7.92 -89.06 3 3 2 34 277.437 4 ↓
Hi High (pH 8-9.5) 2.99 7.44 -38.57 2 3 1 33 276.429 4 ↓

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

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