UCSF

ZINC49306455

Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2010 19 No

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Annotations

None

Vendors

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) -1.38 0.47 -32.74 4 6 1 80 269.369 6
Hi High (pH 8-9.5) -1.38 -0.3 -44.74 4 6 1 83 269.369 6
Mid Mid (pH 6-8) -1.38 1.81 -100.17 5 6 2 84 270.377 6

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

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