UCSF

ZINC49564867

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 18 Yes

Popular Name: 2-[[(1S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]amino]-N-cyclopropyl-N-methyl-acetamide 2-[[(1S,8aR)-1,2,3,5,6,7,8,8a-oc…

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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) 0.86 6.71 -110.74 3 4 2 41 253.39 4 ↓
Hi High (pH 8-9.5) 0.86 5.57 -37.16 2 4 1 37 252.382 4 ↓
Hi High (pH 8-9.5) 0.86 3.31 -7.75 1 4 0 36 251.374 4 ↓
Hi High (pH 8-9.5) 0.86 4.45 -41.91 2 4 1 40 252.382 4 ↓

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

No pre-computed analogs available. Try a structural similarity search.