UCSF

ZINC04779416

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 3rd, 2006 17 Yes

Popular Name: ethyl (2-hydroxy-2-adamantyl)acetate ethyl (2-hydroxy-2-adamantyl)ace…

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CAS Numbers: , 112181-97-2

Download: MOL2 SDF SMILES Flexibase

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) 2.72 -0.03 -7.16 1 3 0 46 238.327 4 ↓

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