UCSF

ZINC58529566

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 8th, 2011 22 No

Popular Name: 3-[[cyclopropyl-[(3-fluorophenyl)methyl]amino]methyl]-5-(methylsulfanylmethyl)-1,3,4-oxadiazole-2-th 3-[[cyclopropyl-[(3-fluorophenyl…

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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) 2.40 8.71 -39.26 1 4 1 35 340.469 7 ↓
Hi High (pH 8-9.5) 2.40 6.22 -9.83 0 4 0 34 339.461 7 ↓

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

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