UCSF

ZINC65493852

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 24 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) 0.86 3.26 -42.09 4 7 1 100 333.412 9
Lo Low (pH 4.5-6) 0.86 2.99 -135.14 5 7 2 102 334.42 9

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

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