UCSF

ZINC04047451

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2005 30 No

Popular Name: 3,3,7,8-tetramethyl-11-[2-(trifluoromethyl)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one 3,3,7,8-tetramethyl-11-[2-(trifl…

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CAS Number: 330957-99-8

Other Names:

MFCD00794581

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) 5.99 2.47 -10.63 2 3 0 41 414.471 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 263 - 265 KeyOrganics

Activity (Go SEA)

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