UCSF

ZINC31934133

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 23 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) 2.35 8.01 -22 2 5 0 62 325.393 3
Mid Mid (pH 6-8) 2.35 8.44 -47.33 3 5 1 64 326.401 3

Activity (Go SEA)

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