UCSF

ZINC39326706

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2010 36 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) 4.34 6.03 -12.2 2 8 0 99 489.572 7
Lo Low (pH 4.5-6) 4.34 6.39 -50.03 3 8 1 101 490.58 7

Activity (Go SEA)

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