UCSF

ZINC38589316

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 17 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) 1.65 4.71 -9.06 1 5 0 79 230.223 3
Lo Low (pH 4.5-6) 1.65 5.26 -45.59 2 5 1 80 231.231 3

Activity (Go SEA)

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