UCSF

ZINC39134007

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2010 11 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) -2.16 -4.31 -11.44 8 7 0 136 156.149 1
Mid Mid (pH 6-8) -2.16 -4.3 -35.73 9 7 1 137 157.157 1

Activity (Go SEA)

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