UCSF

ZINC37820846

Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2009 18 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) -0.36 -0.13 -48.54 5 6 1 92 273.382 3
Mid Mid (pH 6-8) -0.36 -1.19 -17.17 4 6 0 87 272.374 3

Activity (Go SEA)

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