UCSF

ZINC04621979

Substance Information

In ZINC since Heavy atoms Benign functionality
December 14th, 2005 30 Yes

Other Names:

MFCD03864098

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) 3.51 -0.97 -20.92 3 7 0 102 423.542 8

Activity (Go SEA)

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