UCSF

ZINC29219829

Substance Information

In ZINC since Heavy atoms Benign functionality
March 11th, 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) -2.63 5.76 -35.7 1 4 1 32 266.409 3
Mid Mid (pH 6-8) -2.63 8.28 -106.27 2 4 2 34 267.417 3

Activity (Go SEA)

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