UCSF

ZINC14952088

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2008 41 No

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Annotations

Vendors

    None

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) -1.02 3.41 -85.97 8 12 0 204 569.659 15
Mid Mid (pH 6-8) -1.02 3.05 -58.81 7 12 -1 203 568.651 15

Activity (Go SEA)

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