UCSF

ZINC09302382

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 17th, 2007 33 Yes

Popular Name: N-[[5-(1-adamantylcarbamoylmethylsulfanyl)-4-ethyl-1,2,4-triazol-3-yl]methyl]-3-methyl-benzamide N-[[5-(1-adamantylcarbamoylmethy…

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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) 3.91 -2.57 -13.65 2 7 0 88 467.639 8 ↓

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