UCSF

ZINC55542196

Substance Information

In ZINC since Heavy atoms Benign functionality
December 16th, 2010 23 No

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Annotations

None

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) 3.24 8.51 -36.5 0 5 -1 67 325.369 4
Mid Mid (pH 6-8) 2.78 9.77 -10.17 1 5 0 64 326.377 4

Activity (Go SEA)

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