UCSF

ZINC68006027

Substance Information

In ZINC since Heavy atoms Benign functionality
September 19th, 2011 20 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) -2.26 9.61 -36.56 1 4 1 42 271.34 5
Hi High (pH 8-9.5) 2.30 7.09 -16.7 0 4 0 44 270.332 4

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

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