UCSF

ZINC52416646

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2010 19 Yes

Popular Name: 1-[5-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-3-methyl-2-furyl]-N-methyl-methanamine 1-[5-(6,7-dihydro-4H-thieno[3,2-…

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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) 2.44 6.35 -40.93 2 3 1 33 277.413 4 ↓
Lo Low (pH 4.5-6) 2.44 8.53 -95.29 3 3 2 34 278.421 4 ↓

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Rings

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

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