UCSF

ZINC13576929

Substance Information

In ZINC since Heavy atoms Benign functionality
June 22nd, 2008 27 No

Other Names:

MFCD00813636

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) 3.23 10.1 -10.01 1 6 0 77 359.385 5
Ref Reference (pH 7) 3.23 10.06 -14.26 1 6 0 77 359.385 5

Activity (Go SEA)

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