UCSF

ZINC00368986

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2005 22 Yes

Popular Name: 2-(2,4-dichlorophenyl)-3-methylquinoline-4-carboxylic acid 2-(2,4-dichlorophenyl)-3-methylq…

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CAS Numbers: , 350997-47-6

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) 5.30 0.14 -53.36 0 3 -1 53 331.178 2 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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