UCSF

ZINC65734891

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 26th, 2011 36 No

Popular Name: 2-[7-(carboxymethyl)-4,10-bis[(1-oxidopyridin-1-ium-2-yl)methyl]-1,4,7,10-tetrazacyclododec-1-yl]ace 2-[7-(carboxymethyl)-4,10-bis[(1…

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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) -4.88 7.41 -89.15 2 12 0 147 502.572 8 ↓
Hi High (pH 8-9.5) -4.88 4.68 -89.92 1 12 -1 145 501.564 8 ↓

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

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