UCSF

ZINC55053644

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2010 29 Yes

Popular Name: N-[4-[[(5S)-9-(m-tolylmethyl)-2,9-diazaspiro[4.5]decan-2-yl]methyl]phenyl]acetamide N-[4-[[(5S)-9-(m-tolylmethyl)-2,…

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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) 3.42 11.33 -44.32 2 4 1 37 392.567 5 ↓
Hi High (pH 8-9.5) 3.42 8.8 -9.97 1 4 0 36 391.559 5 ↓
Mid Mid (pH 6-8) 3.42 10.84 -41.89 2 4 1 37 392.567 5 ↓

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

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