UCSF

ZINC01743881

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 13 Yes

Other Names:

MFCD11139005

MFCD19380080

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) 0.48 -0.59 -41.81 2 3 0 56 199.637 4

Activity (Go SEA)

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