UCSF

ZINC04705331

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 31st, 2005 31 Yes

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

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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) 2.53 9.94 -14.05 2 9 0 100 421.457 6 ↓
Mid Mid (pH 6-8) 2.71 10.59 -61.74 3 9 1 104 422.465 6 ↓

Activity (Go SEA)

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