UCSF

ZINC19581467

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 4th, 2008 13 Yes

Popular Name: 1-(2-Chloro-phenyl)-N*1*,N*1*-dimethyl-ethane-1,2-diamine 1-(2-Chloro-phenyl)-N*1*,N*1*-di…

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CAS Numbers: 1352305-17-9 , 791601-04-2 , [791601-04-2]

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) 1.36 2.75 -40.11 3 2 1 31 199.705 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 183 - 185 Enamine Building Blocks
MP 183...185 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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