UCSF

ZINC05836563

Substance Information

In ZINC since Heavy atoms Benign functionality
February 17th, 2006 12 Yes

CAS Number: 20743-94-6

Other Names:

MFCD28040488

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) 2.93 4.8 -3.98 0 2 0 18 166.22 4

Activity (Go SEA)

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