UCSF

ZINC01843612

Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2004 22 Yes

CAS Numbers: 19825-63-9 , 68298-00-0

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) 4.11 3.37 -10.36 0 3 0 35 300.398 2

Activity (Go SEA)

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