UCSF

ZINC13125961

Substance Information

In ZINC since Heavy atoms Benign functionality
May 29th, 2008 25 No

Other Names:

MFCD02952298

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) 5.24 10.9 -8.3 1 4 0 50 347.443 3
Ref Reference (pH 7) 5.24 10.42 -8.38 1 4 0 50 347.443 3

Activity (Go SEA)

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