UCSF

ZINC00629958

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 29 Yes

Other Names:

MFCD05884437

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) 3.60 10.54 -25.14 1 6 0 65 387.439 6
Mid Mid (pH 6-8) 3.60 10.98 -39.05 2 6 1 66 388.447 6

Activity (Go SEA)

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