UCSF

ZINC20126974

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2008 15 Yes

Popular Name: N-benzyl-2-(1-pyrrolidinyl)ethanamine N-benzyl-2-(1-pyrrolidinyl)ethan…

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CAS Numbers: 105479-10-5 , 65875-38-9

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) 1.93 7.72 -115.07 3 2 2 21 206.333 5 ↓
Mid Mid (pH 6-8) 1.93 6.22 -33.79 2 2 1 16 205.325 5 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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