UCSF

ZINC59238482

Substance Information

In ZINC since Heavy atoms Benign functionality
February 28th, 2011 35 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) 4.01 10.59 -102.06 0 8 -2 117 486.505 7
Lo Low (pH 4.5-6) 3.55 12.38 -57.88 1 8 -1 113 487.513 7

Activity (Go SEA)

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