UCSF

ZINC66718211

Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2011 26 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) 0.57 3.72 -11.81 3 7 0 100 354.41 6
Lo Low (pH 4.5-6) 0.57 4.18 -44.91 4 7 1 101 355.418 6

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

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