UCSF

ZINC07613003

Substance Information

In ZINC since Heavy atoms Benign functionality
June 7th, 2006 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) -1.91 -0.58 -34.41 0 3 1 20 259.373 3
Mid Mid (pH 6-8) -1.91 2.76 -109.84 1 3 2 21 260.381 3

Activity (Go SEA)

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