UCSF

ZINC20156127

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2008 15 Yes

Popular Name: 5-chloro-2-(pyrrolidin-1-ylcarbonyl)aniline 5-chloro-2-(pyrrolidin-1-ylcarbo…

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CAS Number: 898541-51-0

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) 1.40 4.2 -6.86 2 3 0 46 224.691 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 118 - 120 Enamine Building Blocks
MP 118...120 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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