UCSF

ZINC41227777

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2010 23 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) -1.25 -1.33 -21.8 0 8 0 95 367.493 5
Mid Mid (pH 6-8) -1.25 1.03 -58.07 1 8 1 96 368.501 5

Activity (Go SEA)

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