UCSF

ZINC49281477

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2010 20 No

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

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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) 0.20 3.74 -12.28 0 6 0 60 311.436 3 ↓
Mid Mid (pH 6-8) 0.20 6.12 -43.38 1 6 1 61 312.444 3 ↓

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

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