UCSF

ZINC31945563

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 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) -0.29 2.03 -18.48 2 5 0 63 267.354 4
Mid Mid (pH 6-8) -0.29 4.35 -56.02 3 5 1 64 268.362 4

Activity (Go SEA)

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