UCSF

ZINC17072276

Substance Information

In ZINC since Heavy atoms Benign functionality
September 12th, 2008 25 No

Other Names:

MFCD02952300

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) 5.31 10.64 -8.34 1 4 0 50 347.443 2
Ref Reference (pH 7) 5.31 10.2 -8.27 1 4 0 50 347.443 2

Activity (Go SEA)

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