UCSF

ZINC38530288

Substance Information

In ZINC since Heavy atoms Benign functionality
January 26th, 2010 31 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) 2.86 6.41 -30.81 1 8 0 98 458.927 7
Mid Mid (pH 6-8) 2.86 8.7 -54.5 2 8 1 99 459.935 7

Activity (Go SEA)

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