UCSF

ZINC69079852

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 18th, 2011 17 Yes

Popular Name: (2R)-3-[(4aR,7aR)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl]-2-amino-2-cyclopropyl-pr (2R)-3-[(4aR,7aR)-3,4a,5,6,7,7a-…

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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) 1.19 1.55 -7.16 2 4 0 62 235.331 3 ↓
Lo Low (pH 4.5-6) 1.19 2.26 -49.05 3 4 1 64 236.339 3 ↓
Lo Low (pH 4.5-6) 1.19 3.76 -40.26 3 4 1 63 236.339 3 ↓

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

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