UCSF

ZINC49524439

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2010 27 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) -0.80 6.17 -42.4 3 8 1 98 368.417 5
Mid Mid (pH 6-8) -0.80 5.69 -17.85 2 8 0 96 367.409 5

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

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