UCSF

ZINC08723046

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2007 17 Yes

Popular Name: 2-(3-phenylpropoxy)aniline 2-(3-phenylpropoxy)aniline

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CAS Numbers: 108715-56-6 , 403517-03-3

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) 3.75 -0.29 -4.72 2 2 0 35 227.307 5 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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