UCSF

ZINC07122668

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 18th, 2006 26 Yes

Popular Name: N-(2-cyanoethyl)-2-[[7-(4-fluorophenyl)-5-oxo-9-thia-2,4-diazabicyclo[4.3.0]nona-2,7,10-trien-3-yl]s N-(2-cyanoethyl)-2-[[7-(4-fluoro…

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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) 2.67 5.95 -24.5 2 6 0 99 388.449 6 ↓
Mid Mid (pH 6-8) 3.13 4.71 -49.36 1 6 -1 102 387.441 6 ↓

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