UCSF

ZINC04471341

Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2005 28 No

Other Names:

MFCD02147036

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) 2.77 8.85 -54.64 1 7 -1 102 400.411 4
Ref Reference (pH 7) 2.77 8.28 -56.56 1 7 -1 102 400.411 4

Activity (Go SEA)

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