UCSF

ZINC67934396

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2011 29 Yes

Popular Name: (3,5-dimethylisoxazol-4-yl)-[(5S)-9-[[2-(ethylamino)pyrimidin-5-yl]methyl]-2,9-diazaspiro[4.5]decan- (3,5-dimethylisoxazol-4-yl)-[(5S…

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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) 0.66 9.92 -55.49 2 8 1 89 399.519 5 ↓
Hi High (pH 8-9.5) 0.66 7.81 -12.67 1 8 0 87 398.511 5 ↓

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

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