UCSF

ZINC05188810

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 25th, 2006 23 Yes

Popular Name: 1-(1-Adamantylmethoxy)-3-cyclohexylamino-2-propanol hydrochloride; 2-Propanol, 1-(1-adamantylmethoxy)-3-cyclohexylamino-, hydrochloride; LS-121629 1-(1-Adamantylmethoxy)-3-cyclohe…

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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) 4.28 -3.7 -38.71 3 3 1 46 322.513 7 ↓

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