UCSF

ZINC12463753

Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2008 26 No

Other Names:

MFCD03082797

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) 4.73 9.72 -10.74 0 5 0 53 368.458 5
Ref Reference (pH 7) 4.73 10.06 -10.66 0 5 0 53 368.458 5

Activity (Go SEA)

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