UCSF

ZINC02392262

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 23 Yes

CAS Number: [41060-16-6]

Other Names:

MFCD02259466

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) 3.00 -0.15 -13.09 2 6 0 89 314.293 3

Activity (Go SEA)

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