UCSF

ZINC37829089

Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2009 19 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) 2.19 6.76 -8.87 0 3 0 24 300.855 6
Mid Mid (pH 6-8) 2.19 8.97 -47.6 1 3 1 25 301.863 6

Activity (Go SEA)

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