UCSF

ZINC67741637

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 14th, 2011 22 Yes

Popular Name: 1-[5-[(1-ethylindol-3-yl)sulfanylmethyl]-1,2,4-oxadiazol-3-yl]-N,N-dimethyl-methanamine 1-[5-[(1-ethylindol-3-yl)sulfany…

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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) 2.46 8.64 -42.32 1 5 1 48 317.438 6 ↓
Hi High (pH 8-9.5) 2.46 6.2 -10.76 0 5 0 47 316.43 6 ↓

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

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