UCSF

ZINC01017413

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 6th, 2004 13 Yes

Popular Name: 2,6,6-Trimethyl-6,7-dihydro-1H-indol-4(5H)-one 2,6,6-Trimethyl-6,7-dihydro-1H-i…

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CAS Numbers: 69595-03-5 , [69595-03-5]

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) 2.23 5.43 -10.74 1 2 0 33 177.247 0 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

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