UCSF

ZINC05076615

Substance Information

In ZINC since Heavy atoms Benign functionality
January 19th, 2006 22 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) 4.43 11.39 -38.43 0 3 -1 35 348.234 2
Mid Mid (pH 6-8) 4.43 11.5 -12.07 1 3 0 36 349.242 2

Activity (Go SEA)

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