UCSF

ZINC01096568

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 20 Yes

Other Names:

MFCD01026383

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) 3.10 8.87 -54.24 0 5 -1 67 267.264 4
Mid Mid (pH 6-8) 3.10 9.32 -65.61 1 5 0 68 268.272 4

Vendor Notes

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

Activity (Go SEA)

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