UCSF

ZINC04306650

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2005 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) 0.97 5.84 -47.69 2 6 1 85 231.235 4
Lo Low (pH 4.5-6) 0.97 6.12 -97.36 3 6 2 86 232.243 4

Activity (Go SEA)

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