UCSF

ZINC59250569

Substance Information

In ZINC since Heavy atoms Benign functionality
February 28th, 2011 18 No

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Annotations

Vendors

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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) 2.38 3.31 -8.95 1 4 0 44 256.39 8
Lo Low (pH 4.5-6) 2.38 5.61 -41.61 2 4 1 45 257.398 8

Activity (Go SEA)

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