UCSF

ZINC04529392

Substance Information

In ZINC since Heavy atoms Benign functionality
December 7th, 2005 11 No

CAS Numbers: 21915-53-7 , 98819-68-2

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) 1.10 -3.05 -6.07 1 2 0 33 150.177 2

Activity (Go SEA)

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