UCSF

ZINC60220164

Substance Information

In ZINC since Heavy atoms Benign functionality
March 17th, 2011 15 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) -4.22 2.49 -30.81 3 7 1 90 208.201 1
Mid Mid (pH 6-8) 0.10 1.99 -22.79 2 7 0 88 207.193 1

Activity (Go SEA)

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