UCSF

ZINC34648107

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2009 23 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) -0.91 -1.76 -52.07 4 11 -1 169 362.284 4
Mid Mid (pH 6-8) -0.91 -0.89 -135.5 4 11 -2 169 361.276 4

Activity (Go SEA)

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