UCSF

ZINC08741553

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2007 37 No

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) 5.57 15.26 -15.23 0 7 0 76 516.619 6
Ref Reference (pH 7) 5.57 15.28 -13.81 0 7 0 76 516.619 6

Activity (Go SEA)

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