UCSF

ZINC05778857

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 13th, 2006 27 Yes

Popular Name: 3-[[5-(3,4-dimethylphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-8-methyl-2,6-diazabicyclo[4.4.0]deca 3-[[5-(3,4-dimethylphenyl)-1,3,4…

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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) 4.70 7.04 -15.68 0 6 0 73 378.457 4 ↓
Lo Low (pH 4.5-6) 4.70 7.45 -39.43 1 6 1 75 379.465 4 ↓

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

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