UCSF

ZINC01446448

Substance Information

In ZINC since Heavy atoms Benign functionality
August 19th, 2004 17 Yes

CAS Numbers: 3258-07-9 , 58-96-8

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) -2.09 -8.72 -21.67 4 8 0 124 244.203 2

Activity (Go SEA)

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