UCSF

ZINC37189871

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2009 20 Yes

Popular Name: 4-[2-(1-adamantyl)ethylsulfanyl]pyridin-3-amine 4-[2-(1-adamantyl)ethylsulfanyl]…

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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) 3.92 8.08 -3.94 2 2 0 39 288.46 4 ↓
Lo Low (pH 4.5-6) 3.92 8.54 -31.85 3 2 1 40 289.468 4 ↓

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