UCSF

ZINC69052164

Substance Information

In ZINC since Heavy atoms Benign functionality
October 18th, 2011 20 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) 3.83 5.91 -9.5 0 3 0 34 322.48 5
Lo Low (pH 4.5-6) 3.83 6.91 -32.26 1 3 1 36 323.488 5

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

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