UCSF

ZINC15319673

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2008 33 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) 5.17 11.91 -10.38 0 6 0 82 506.407 6
Mid Mid (pH 6-8) 5.35 11.64 -10.13 0 6 0 82 506.407 6
Mid Mid (pH 6-8) 5.35 12.62 -10.86 0 6 0 82 506.407 6
Mid Mid (pH 6-8) 5.17 11.83 -10.77 0 6 0 82 506.407 6

Activity (Go SEA)

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