UCSF

ZINC02583313

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 20 Yes

CAS Numbers: 102507-18-6 , 93847-77-9

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) 1.52 -2.34 -47.73 2 6 -1 98 280.3 6

Activity (Go SEA)

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