UCSF

ZINC19230059

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2008 14 Yes

Popular Name: N-(2-amino-2-phenylethyl)-N,N-diethylamine N-(2-amino-2-phenylethyl)-N,N-di…

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CAS Number: 31788-87-1

Other Names:

MFCD06655367

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) 0.21 5.95 -30.31 3 2 1 30 193.314 5 ↓
Hi High (pH 8-9.5) 0.21 4.49 -40.98 3 2 1 31 193.314 5 ↓

Vendor Notes

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

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