UCSF

ZINC39081226

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2010 11 Yes

Popular Name: 2-Butanol, 3-methyl-3-[methyl(1-methylethyl)amino]- (9CI) 2-Butanol, 3-methyl-3-[methyl(1-…

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CAS Number: 753395-71-0

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) 1.56 2.74 -28.58 2 2 1 25 160.281 3 ↓

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