UCSF

ZINC03794575

Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2005 25 Yes

CAS Number: 124555-18-6

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) -0.23 -13.5 -17.5 5 10 0 145 351.363 4

Activity (Go SEA)

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