UCSF

ZINC95611336

Substance Information

In ZINC since Heavy atoms Benign functionality
January 9th, 2014 13 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) 0.49 1.07 -37.75 5 3 1 52 178.259 1
Hi High (pH 8-9.5) 0.49 1 -1.91 4 3 0 50 177.251 1

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

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