UCSF

ZINC36366237

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2009 30 Yes

Popular Name: (4S)-4-(1,3-dimethyl-2-oxo-benzimidazol-5-yl)-3-methyl-1-(6-oxo-1H-pyridazin-3-yl)-5,7-dihydro-4H-py (4S)-4-(1,3-dimethyl-2-oxo-benzi…

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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) 1.38 2.68 -60.79 1 10 -1 126 404.41 2 ↓
Lo Low (pH 4.5-6) 0.92 4.57 -21.4 2 10 0 123 405.418 2 ↓
Lo Low (pH 4.5-6) 0.74 7.22 -22.18 2 10 0 120 405.418 2 ↓

Activity (Go SEA)

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