UCSF

ZINC01550212

Substance Information

In ZINC since Heavy atoms Benign functionality
October 20th, 2005 15 No

CAS Number: 339068-25-6

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) 3.57 6.32 -34.27 3 3 1 46 207.297 5

Activity (Go SEA)

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