UCSF

ZINC59522153

Substance Information

In ZINC since Heavy atoms Benign functionality
March 6th, 2011 29 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) -1.46 5.34 -89.25 4 10 0 155 412.487 10
Mid Mid (pH 6-8) -1.46 5.02 -67.34 3 10 -1 153 411.479 10

Activity (Go SEA)

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