UCSF

ZINC39271873

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2010 18 Yes

Popular Name: 4-(1,4-Dioxa-8-azaspiro[4.5]decan-8-yl)benzonitrile 4-(1,4-Dioxa-8-azaspiro[4.5]deca…

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CAS Number: 79421-39-9

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) 2.07 6.14 -7.3 0 4 0 45 244.294 1 ↓

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