UCSF

ZINC49386684

Substance Information

In ZINC since Heavy atoms Benign functionality
September 28th, 2010 35 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) 2.91 8.46 -22.19 0 9 0 75 482.581 9
Mid Mid (pH 6-8) 2.91 10.71 -55.95 1 9 1 76 483.589 9

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

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