UCSF

ZINC12954430

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 23rd, 2008 34 Yes

Popular Name: 4-methyl-N-{2-[(4-methylbenzoyl)(2-thienylmethyl)amino]ethyl}-N-(2-thienylmethyl)benzenecarboxamide 4-methyl-N-{2-[(4-methylbenzoyl)…

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CAS Number: 338775-19-2

Other Names:

MFCD00243928

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) 4.99 14.44 -13.22 0 4 0 41 488.678 9 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 119 - 121 KeyOrganics

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