UCSF

ZINC19963876

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2008 14 Yes

Popular Name: (5-methylhexan-2-yl)(oxolan-2-ylmethyl)amine (5-methylhexan-2-yl)(oxolan-2-yl…

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CAS Number: 1020977-12-1

Other Names:

MFCD11147037

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) 2.73 6.02 -33.18 2 2 1 26 200.346 6 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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