UCSF

ZINC59487563

Substance Information

In ZINC since Heavy atoms Benign functionality
March 5th, 2011 19 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) 5.56 11.3 -30.86 2 2 1 20 271.513 12
Mid Mid (pH 6-8) 5.56 11.34 -113.42 3 2 2 21 272.521 12

Activity (Go SEA)

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