UCSF

ZINC34937027

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 15 No

Other Names:

MFCD10692724

MFCD14236671

Download: MOL2 SDF SMILES Flexibase

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) 2.94 6.55 -9.59 0 3 0 33 222.675 2
Ref Reference (pH 7) 2.77 6.21 -14.72 1 3 0 38 222.675 2
Mid Mid (pH 6-8) 3.23 4.29 -7.16 1 3 0 38 222.675 2

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks

Activity (Go SEA)

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