UCSF

ZINC59513805

Substance Information

In ZINC since Heavy atoms Benign functionality
March 6th, 2011 22 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) 3.88 7.42 -9.5 1 4 0 47 294.354 4
Lo Low (pH 4.5-6) 3.88 7.41 -28.15 2 4 1 48 295.362 4

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

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