UCSF

ZINC59839398

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 11th, 2011 11 Yes

Popular Name: (2S)-1-ethoxy-N,4-dimethyl-pentan-2-amine (2S)-1-ethoxy-N,4-dimethyl-penta…

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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) 2.10 3.93 -32.86 2 2 1 26 160.281 6 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0580637A1; US5180724 IBM Patent Data

Activity (Go SEA)

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