UCSF

ZINC37818101

Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 2009 17 No

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Annotations

None

Vendors

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) -0.60 0.4 -41.84 3 6 1 75 262.355 6
Mid Mid (pH 6-8) -0.60 -0.84 -13.12 2 6 0 71 261.347 6

Activity (Go SEA)

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