UCSF

ZINC02559777

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 21 Yes

Popular Name: Ethyl 7-(DiethylaMino)couMarin-3-carboxylate Ethyl 7-(DiethylaMino)couMarin-3…

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CAS Number: 28705-46-6

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) 2.98 4.05 -18.99 0 5 0 59 289.331 6 ↓

Vendor Notes

Note Type Comments Provided By
MP 86 TCI

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

No pre-computed analogs available. Try a structural similarity search.