UCSF

ZINC71527251

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 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) 0.99 3.07 -63.87 0 8 -1 118 346.344 4
Lo Low (pH 4.5-6) 0.81 4.88 -23.22 1 8 0 111 347.352 4

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

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