UCSF

ZINC40927209

Substance Information

In ZINC since Heavy atoms Benign functionality
April 13th, 2010 26 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) 4.83 11.36 -10.22 1 4 0 66 359.454 5
Mid Mid (pH 6-8) 5.76 10.51 -11.74 1 4 0 69 359.454 4

Activity (Go SEA)

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