UCSF

ZINC65500648

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 29 No

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Annotations

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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) 2.25 5.59 -14.84 3 8 0 102 410.503 5
Hi High (pH 8-9.5) 2.44 3 -49.3 2 8 -1 109 409.495 5

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

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