UCSF

ZINC36377951

Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2009 19 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) -2.08 3.15 -16.18 1 8 0 102 262.225 3
Mid Mid (pH 6-8) -2.08 2.35 -40.24 2 8 1 99 263.233 3

Activity (Go SEA)

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