UCSF

ZINC00140482

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 22 Yes

CAS Number: 442633-00-3

Other Names:

CK-666-d4

CK-666-d4

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) 3.42 -0.52 -16.7 2 3 0 44 296.345 4

Activity (Go SEA)

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