UCSF

ZINC49917706

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2010 37 No

Popular Name: 4-bromo-6-[(E)-[[4-(4-methoxyanilino)-6-(4-nitroanilino)-1,3,5-triazin-2-yl]hydrazono]methyl]benzene 4-bromo-6-[(E)-[[4-(4-methoxyani…

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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 13.29 -15.09 5 13 0 183 567.36 9 ↓
Hi High (pH 8-9.5) 5.99 14.06 -47.15 4 13 -1 185 566.352 9 ↓
Hi High (pH 8-9.5) 5.99 14.06 -48 4 13 -1 185 566.352 9 ↓

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

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