UCSF

ZINC59218926

Substance Information

In ZINC since Heavy atoms Benign functionality
February 27th, 2011 18 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) 3.41 9.57 -52.17 0 4 -1 60 256.366 11
Lo Low (pH 4.5-6) 3.41 7.6 -12.47 1 4 0 58 257.374 11

Activity (Go SEA)

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