UCSF

ZINC13408023

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 18th, 2008 35 No

Popular Name: (3S,6R,9R,13S)-9-benzyl-13-isopropyl-6-methyl-3-[(2R)-2-methylhexyl]-1-oxa-4,7,10-triazacyclotrideca (3S,6R,9R,13S)-9-benzyl-13-isopr…

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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) 3.80 9.68 -16.53 3 8 0 114 487.641 8 ↓

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

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