UCSF

ZINC08274943

Substance Information

In ZINC since Heavy atoms Benign functionality
July 7th, 2006 20 No

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Annotations

Vendors

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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) 2.14 6.03 -18.85 2 6 0 91 277.255 5
Mid Mid (pH 6-8) 2.14 5.52 -32.12 1 6 -1 89 276.247 5

Activity (Go SEA)

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