UCSF

ZINC04105118

Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2005 14 Yes

Other Names:

MFCD03717905

MFCD05669135

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) 3.31 1.67 -36.51 1 2 1 13 235.134 4

Activity (Go SEA)

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