UCSF

ZINC38212370

Substance Information

In ZINC since Heavy atoms Benign functionality
January 12th, 2010 17 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) -4.39 -0.31 -43.19 5 7 0 121 235.247 2
Mid Mid (pH 6-8) -4.39 -0.23 -72.86 6 7 1 122 236.255 2

Activity (Go SEA)

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