UCSF

ZINC03954146

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2005 15 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) -0.08 6.9 -96.74 0 6 -2 84 222.229 3
Lo Low (pH 4.5-6) -0.80 7.28 -53.71 1 6 -1 87 223.237 3

Activity (Go SEA)

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