UCSF

ZINC69461017

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2011 22 Yes

Popular Name: 3-methyl-5-[[4-(7H-purin-6-yl)piperazin-1-yl]methyl]-1,2,4-oxadiazole 3-methyl-5-[[4-(7H-purin-6-yl)pi…

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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) 0.22 4.17 -14.49 1 9 0 100 300.326 3 ↓
Mid Mid (pH 6-8) 0.22 6.39 -49.26 2 9 1 101 301.334 3 ↓

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

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