UCSF

ZINC39988426

Substance Information

In ZINC since Heavy atoms Benign functionality
March 20th, 2010 26 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) -0.79 0.97 -46.9 3 8 1 94 377.502 3
Mid Mid (pH 6-8) -0.79 0.71 -9.07 2 8 0 93 376.494 3

Activity (Go SEA)

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