UCSF

ZINC03945984

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2005 27 No

CAS Number: 49697-38-3

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) 4.09 9.79 -14.35 1 3 0 54 370.533 2

Activity (Go SEA)

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