UCSF

ZINC04251200

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2005 30 Yes

Popular Name: N-(2,4-dimethylphenyl)-2-[[8-(4-methoxyphenyl)-5,6,9-triazabicyclo[4.3.0]nona-2,4,7,9-tetraen-4-yl]s N-(2,4-dimethylphenyl)-2-[[8-(4-…

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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) 4.87 10.94 -15.16 1 6 0 69 418.522 6 ↓
Mid Mid (pH 6-8) 4.87 11.38 -37.98 2 6 1 70 419.53 6 ↓

Activity (Go SEA)

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