UCSF

ZINC34537615

Substance Information

In ZINC since Heavy atoms Benign functionality
August 31st, 2009 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) -2.15 2.57 -68.67 4 6 -1 128 272.217 5
Mid Mid (pH 6-8) -2.15 3.62 -152.46 3 6 -2 131 271.209 5

Activity (Go SEA)

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