UCSF

ZINC34551509

Substance Information

In ZINC since Heavy atoms Benign functionality
August 31st, 2009 26 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) -0.92 10.25 -43.6 1 6 1 71 355.414 5
Hi High (pH 8-9.5) 3.13 9.71 -10.93 1 6 0 72 354.406 5

Activity (Go SEA)

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