UCSF

ZINC04136890

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2005 26 Yes

Popular Name: allyl-[2-(2-hydroxyethoxy)ethylamino]-methyl-BLAHcarbonitrile allyl-[2-(2-hydroxyethoxy)ethyla…

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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) 2.88 -4.89 -19.17 2 6 0 82 350.422 8 ↓

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