UCSF

ZINC06255359

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2006 25 Yes

Popular Name: 2-(4-Isopropoxyphenyl)-6,8-dimethylquinoline-4-carboxylic acid 2-(4-Isopropoxyphenyl)-6,8-dimet…

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CAS Numbers: , 895966-49-1

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) 5.23 1.5 -53.56 0 4 -1 62 334.395 4 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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