UCSF

ZINC00140169

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 18 Yes

Popular Name: ethyl 4,7-dichloro-8-methylquinoline-3-carboxylate ethyl 4,7-dichloro-8-methylquino…

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CAS Number: 58666-08-3

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) 4.07 1.58 -4.87 0 3 0 39 284.142 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 105 - 107 KeyOrganics

Activity (Go SEA)

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