UCSF

ZINC34477595

Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2009 12 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) -0.20 4.89 -35.45 1 3 1 39 170.232 1
Mid Mid (pH 6-8) -0.20 2.9 -4.95 0 3 0 37 169.224 1

Activity (Go SEA)

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