UCSF

ZINC36470672

Substance Information

In ZINC since Heavy atoms Benign functionality
November 5th, 2009 24 Yes

CAS Number: [146346-88-5]

Other Names:

MFCD20264827

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) 5.29 8.89 -8.85 1 5 0 65 325.364 6

Activity (Go SEA)

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