UCSF

ZINC05159729

Substance Information

In ZINC since Heavy atoms Benign functionality
January 23rd, 2006 21 No

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Annotations

Vendors

    None

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) -3.66 0.97 -33.03 4 6 1 96 309.415 6
Lo Low (pH 4.5-6) -3.66 1.41 -86.94 5 6 2 97 310.423 6

Activity (Go SEA)

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