UCSF

ZINC32121882

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2009 20 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) 3.36 9.86 -48.78 1 3 1 31 276.4 6
Mid Mid (pH 6-8) 3.36 7.59 -6.98 0 3 0 30 275.392 6

Activity (Go SEA)

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