UCSF

ZINC59514494

Substance Information

In ZINC since Heavy atoms Benign functionality
March 6th, 2011 28 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) 3.59 11.67 -31.49 0 9 -1 137 436.834 4
Lo Low (pH 4.5-6) 3.59 10.67 -17.06 1 9 0 134 437.842 4

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

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