UCSF

ZINC14645348

Substance Information

In ZINC since Heavy atoms Benign functionality
July 13th, 2008 24 Yes

CAS Number: [98755-25-0]

Other Names:

MFCD20260540

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) 2.69 2.03 -13.01 3 7 0 109 330.292 3

Activity (Go SEA)

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