UCSF

ZINC00163945

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2005 18 Yes

Popular Name: N-benzyl-1-(5-methyl-2-furyl)but-3-en-1-amine N-benzyl-1-(5-methyl-2-furyl)but…

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CAS Numbers: 1052536-24-9 , 212117-20-9 , 3027-13-2

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) 3.47 1.65 -35.3 2 2 1 29 242.342 6 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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