UCSF

ZINC00440366

Substance Information

In ZINC since Heavy atoms Benign functionality
October 16th, 2005 17 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) 2.07 3.93 -31.78 2 4 -1 72 288.135 1
Mid Mid (pH 6-8) 2.07 3.3 -15.59 3 4 0 69 289.143 1

Activity (Go SEA)

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