UCSF

ZINC00725556

Substance Information

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

Other Names:

MFCD00612583

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) 4.55 0.93 -8.4 0 6 0 61 406.511 6
Mid Mid (pH 6-8) 4.55 1.15 -34.47 1 6 1 63 407.519 6

Activity (Go SEA)

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