UCSF

ZINC19960102

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2008 14 Yes

Popular Name: (1-cyclopropylethyl)[(1-ethylpyrrolidin-2-yl)methyl]amine (1-cyclopropylethyl)[(1-ethylpyr…

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CAS Number: 1021000-97-4

Other Names:

MFCD11146488

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) 2.09 7.74 -109.38 3 2 2 21 198.354 5 ↓
Mid Mid (pH 6-8) 2.09 5.57 -32.23 2 2 1 20 197.346 5 ↓

Vendor Notes

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

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