UCSF

ZINC04202515

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 22 Yes

CAS Number: 7735-43-5

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) 7.67 -2.29 -4.44 2 2 0 40 314.554 19

Activity (Go SEA)

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