UCSF

ZINC69463979

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2011 19 Yes

Popular Name: (2R,3R)-N-[(1S)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]-3-(4-methylpyrazol-1-yl)butan-2-amine (2R,3R)-N-[(1S)-1-(5-methyl-1,3,…

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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) 0.24 1.11 -47.55 2 6 1 73 264.353 5 ↓
Hi High (pH 8-9.5) 0.24 0.16 -9.44 1 6 0 69 263.345 5 ↓

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

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