UCSF

ZINC33751828

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2009 22 No

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Annotations

Vendors

    None

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) -4.09 -6.14 -236.56 4 12 -3 212 345.173 7
Mid Mid (pH 6-8) -4.09 -7.3 -119.5 5 12 -2 209 346.181 7

Activity (Go SEA)

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