UCSF

ZINC01666553

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 16 Yes

Popular Name: 4-(naphthalen-2-yl)butanoic acid 4-(naphthalen-2-yl)butanoic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 782-28-5 , [782-28-5]

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) 3.33 9.67 -47.02 0 2 -1 40 213.256 4 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks
MP 91 - 93 Enamine Building Blocks
MP 91...93 Enamine Building Blocks
purity 95 Enamine Building Blocks

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