UCSF

ZINC49564796

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 20 No

Popular Name: (2R)-1-[[(1R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]amino]-3-(1,2,5-thiadiazol-3-yloxy)propan (2R)-1-[[(1R,8aR)-1,2,3,5,6,7,8,…

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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) 0.90 -1.34 -42.95 3 6 1 75 299.42 6 ↓
Hi High (pH 8-9.5) 0.90 -2.6 -4.89 2 6 0 71 298.412 6 ↓
Mid Mid (pH 6-8) 0.90 -0.34 -33.42 3 6 1 72 299.42 6 ↓

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Rings

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

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