UCSF

ZINC13513786

Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2008 24 No

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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) 4.46 7.51 -9.65 1 5 0 64 340.404 4
Ref Reference (pH 7) 4.46 7.09 -9.76 1 5 0 64 340.404 4
Ref Reference (pH 7) 3.97 6.91 -44.57 0 5 -1 63 339.396 5

Activity (Go SEA)

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