UCSF

ZINC33835113

Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2009 26 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) -2.15 -7.42 -63.81 5 10 -1 169 373.334 5
Lo Low (pH 4.5-6) -2.15 -8.52 -20.81 6 10 0 166 374.342 5

Activity (Go SEA)

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