UCSF

ZINC07262374

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 23rd, 2006 14 Yes

Popular Name: (4-isopropylbenzyl)propylamine (4-isopropylbenzyl)propylamine

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CAS Number: 889950-02-1

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) 3.89 0.91 -37.42 2 1 1 16 192.326 5 ↓

Vendor Notes

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

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