UCSF

ZINC37023758

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2009 21 Yes

Popular Name: (2R,3aS,7aR)-N-[(1R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]-2,3,3a,4,5,6,7,7a-octahydro-1H-in (2R,3aS,7aR)-N-[(1R,8aR)-1,2,3,5…

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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) 3.04 6.99 -90.84 4 4 2 50 293.455 2 ↓
Hi High (pH 8-9.5) 3.04 5.79 -40.14 3 4 1 46 292.447 2 ↓

Activity (Go SEA)

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