UCSF

ZINC09138114

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 9th, 2007 26 Yes

Popular Name: 2-(4-hydroxy-3-methoxy-phenyl)-9-methyl-7-phenyl-5,7,8-triazabicyclo[4.3.0]nona-4,8,10-trien-4-ol 2-(4-hydroxy-3-methoxy-phenyl)-9…

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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) 2.15 6.64 -11.43 2 6 0 76 349.39 3 ↓
Lo Low (pH 4.5-6) 2.33 6.87 -33 3 6 1 81 350.398 3 ↓

Activity (Go SEA)

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