UCSF

ZINC08833495

Substance Information

In ZINC since Heavy atoms Benign functionality
July 29th, 2007 29 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) 5.42 10.94 -13.72 2 7 0 104 406.829 4
Lo Low (pH 4.5-6) 5.42 11.36 -33.4 3 7 1 105 407.837 4

Activity (Go SEA)

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