UCSF

ZINC19230156

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2008 12 Yes

Popular Name: 3-(3-Pyridylmethylamino)propionitrile 3-(3-Pyridylmethylamino)propioni…

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CAS Numbers: 33611-48-2 , [33611-48-2]

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) -0.28 2.53 -9.56 1 3 0 49 161.208 4 ↓

Vendor Notes

Note Type Comments Provided By
BP 241°/50mm Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific
Warnings Irritant-Harmful/Stored under Argon Matrix Scientific

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