UCSF

ZINC33765791

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2009 32 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) 5.60 11.69 -59.5 1 6 -1 106 459.787 6
Mid Mid (pH 6-8) 5.78 11.89 -97.3 0 6 -2 112 458.779 6

Activity (Go SEA)

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