UCSF

ZINC01683103

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 9 Yes

CAS Number: 16525-39-6

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) 1.08 5.17 -11.89 0 2 0 48 122.171 3

Activity (Go SEA)

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