UCSF

ZINC65531533

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 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) 1.16 1.82 -15.9 2 6 0 86 261.329 5
Lo Low (pH 4.5-6) 1.16 2.74 -33.98 3 6 1 87 262.337 5

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

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