UCSF

ZINC49383350

Substance Information

In ZINC since Heavy atoms Benign functionality
September 27th, 2010 29 Yes

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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) 2.93 8.97 -22.35 1 8 0 92 424.429 8
Hi High (pH 8-9.5) 2.75 7.64 -54.08 0 8 -1 98 423.421 8

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

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