UCSF

ZINC09316697

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 18th, 2007 33 Yes

Popular Name: N-[3,5-bis(4-chlorophenyl)-2,6,7,9-tetrazabicyclo[4.3.0]nona-1,3,7-trien-8-yl]-4-fluoro-benzamide N-[3,5-bis(4-chlorophenyl)-2,6,7…

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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) 5.83 16.71 -21.27 1 6 0 72 480.33 4 ↓
Hi High (pH 8-9.5) 5.83 17.71 -15.01 2 6 0 75 480.33 4 ↓
Hi High (pH 8-9.5) 5.83 17.44 -44.93 1 6 -1 73 479.322 4 ↓
Mid Mid (pH 6-8) 5.83 17.04 -46.61 2 6 1 74 481.338 4 ↓

Activity (Go SEA)

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