UCSF

ZINC06693926

Substance Information

In ZINC since Heavy atoms Benign functionality
April 15th, 2006 30 No

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Annotations

Vendors

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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) 3.86 17.47 -39.45 2 4 1 34 425.597 11
Mid Mid (pH 6-8) 3.86 16.96 -15.27 1 4 0 33 424.589 11

Activity (Go SEA)

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