UCSF

ZINC06380495

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 25th, 2006 12 Yes

Popular Name: (3-chlorobenzyl)propylamine (3-chlorobenzyl)propylamine

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CAS Number: 39190-98-2

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) 3.03 -0.04 -40.59 2 1 1 16 184.69 4 ↓

Vendor Notes

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

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