UCSF

ZINC43441933

Substance Information

In ZINC since Heavy atoms Benign functionality
May 14th, 2010 21 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) 3.50 6.94 -42.27 3 5 1 72 334.223 7
Mid Mid (pH 6-8) 3.50 5.73 -10.5 2 5 0 67 333.215 7

Activity (Go SEA)

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