UCSF

ZINC00085497

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 15 Yes

Popular Name: 6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one 6-methyl-2,3,4,9-tetrahydro-1H-c…

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CAS Numbers: 3449-48-7 , [3449-48-7]

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) 3.10 6.68 -7.57 1 2 0 33 199.253 0 ↓

Vendor Notes

Note Type Comments Provided By
MP 185 - 187 Enamine Building Blocks
MP 185...187 Enamine Building Blocks
MP 194 - 196 Enamine Building Blocks
MP 195-196° Matrix Scientific
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% )