UCSF

ZINC71538359

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2011 34 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) 4.57 11.45 -21.68 2 7 0 109 452.466 5
Hi High (pH 8-9.5) 4.75 10.12 -67.88 1 7 -1 116 451.458 5

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

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