UCSF

ZINC01383926

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 37 No

Popular Name: 4-[16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9(14),10,12-hexaen-17-yl]-N-(2-methylphenyl)benzenecarboxamide 4-[16,18-dioxo-17-azapentacyclo[…

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CAS Number: 956960-36-4

Other Names:

MFCD03349538

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) 5.33 15.13 -12.73 1 5 0 66 484.555 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 276 - 277 KeyOrganics

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Rings

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