UCSF

ZINC31943636

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 16 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) 1.76 6.3 -19.47 2 3 0 44 274.176 2
Lo Low (pH 4.5-6) 1.76 6.71 -42.71 3 3 1 45 275.184 2

Activity (Go SEA)

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