UCSF

ZINC31833866

Substance Information

In ZINC since Heavy atoms Benign functionality
April 17th, 2009 18 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) 4.26 3.78 -46.6 1 5 -1 73 326.561 3
Lo Low (pH 4.5-6) 3.80 4.58 -15.8 2 5 0 70 327.569 3

Activity (Go SEA)

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