UCSF

ZINC59815978

Substance Information

In ZINC since Heavy atoms Benign functionality
March 11th, 2011 34 No

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Annotations

Vendors

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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) 2.87 10.43 -109.37 0 9 -2 129 541.028 9
Mid Mid (pH 6-8) 2.87 9.55 -63.56 1 9 -1 127 542.036 9

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

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