UCSF

ZINC40339697

Substance Information

In ZINC since Heavy atoms Benign functionality
April 6th, 2010 37 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) 4.61 16.06 -42.11 2 7 1 77 490.587 9
Mid Mid (pH 6-8) 4.61 15.55 -21.15 1 7 0 76 489.579 9

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

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