UCSF

ZINC19300873

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 30th, 2008 15 Yes

Popular Name: 1-[(Dimethylamino)methyl]-1H-indole-2,3-dione 1-[(Dimethylamino)methyl]-1H-ind…

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CAS Numbers: 13129-67-4 , [13129-67-4]

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) 0.92 3.4 -10.46 0 4 0 42 204.229 2 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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