UCSF

ZINC38420578

Substance Information

In ZINC since Heavy atoms Benign functionality
January 22nd, 2010 23 No

CAS Number: 93755-77-2

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) 2.85 5.72 -48.98 2 6 -1 99 312.301 5

Activity (Go SEA)

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