UCSF

ZINC38731907

Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2010 19 No

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Annotations

None

Vendors

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) 0.92 5.58 -10.18 1 5 0 62 275.333 4
Mid Mid (pH 6-8) 1.11 5.89 -48.83 0 5 -1 69 274.325 4

Activity (Go SEA)

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