UCSF

ZINC69796323

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 30th, 2011 23 No

Popular Name: 5-ethoxy-3-[[(3R)-3-(morpholinomethyl)-1-piperidyl]methyl]-1,3,4-thiadiazole-2-thione 5-ethoxy-3-[[(3R)-3-(morpholinom…

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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) 1.61 2.9 -6.82 0 6 0 43 358.533 6 ↓
Mid Mid (pH 6-8) 1.61 5.38 -39.05 1 6 1 44 359.541 6 ↓
Mid Mid (pH 6-8) 1.61 4.89 -40.63 1 6 1 44 359.541 6 ↓

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

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