UCSF

ZINC03781943

Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2005 31 No

CAS Number: 86541-75-5

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) 2.52 1.64 -57.87 2 7 0 103 424.497 10

Activity (Go SEA)

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