UCSF

ZINC04172766

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2005 38 No

Popular Name: [2-methoxy-4-[4-methyl-9-(1,1,3,3-tetramethylbutylamino)-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraen [2-methoxy-4-[4-methyl-9-(1,1,3,…

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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) 7.42 18.54 -30.85 2 6 1 66 512.674 10 ↓
Hi High (pH 8-9.5) 7.42 18.19 -15.98 1 6 0 65 511.666 10 ↓
Mid Mid (pH 6-8) 7.42 18.65 -93.73 3 6 2 71 513.682 10 ↓

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