UCSF

ZINC18153831

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2008 30 No

Popular Name: 17-[(4-chlorobenzyl)oxy]-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2(7),3,5,9(14),10,12-hexaene-16,18-dione 17-[(4-chlorobenzyl)oxy]-17-azap…

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CAS Number: 478029-46-8

Other Names:

MFCD02102624

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) 4.57 14.2 -11.08 0 4 0 47 415.876 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 243 - 246 KeyOrganics

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

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