UCSF

ZINC64219535

Substance Information

In ZINC since Heavy atoms Benign functionality
June 14th, 2011 13 Yes

Download: MOL2 SDF SMILES Flexibase

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) -1.87 3.65 -41.08 3 5 0 94 189.211 6
Hi High (pH 8-9.5) -1.87 3.44 -52.48 2 5 -1 92 188.203 6

Vendor Notes

Note Type Comments Provided By
MP 107-109o C Indofine

Activity (Go SEA)

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