UCSF

ZINC38717988

Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2010 25 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) -0.73 -0.24 -11.28 2 9 0 100 356.423 7
Mid Mid (pH 6-8) -0.73 2.03 -47.4 3 9 1 101 357.431 7

Activity (Go SEA)

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