UCSF

ZINC04736959

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 2nd, 2006 30 Yes

Popular Name: N-(2,4-dimethoxyphenyl)-2-(3-hydroxyphenyl)-4-methyl-1,5,7,9-tetrazabicyclo[4.3.0]nona-3,6,8-triene- N-(2,4-dimethoxyphenyl)-2-(3-hyd…

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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) 2.36 7.28 -12.38 3 9 0 111 407.43 5 ↓
Mid Mid (pH 6-8) 2.54 8.15 -56.52 4 9 1 115 408.438 5 ↓

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

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