UCSF

ZINC44137893

Substance Information

In ZINC since Heavy atoms Benign functionality
May 22nd, 2010 26 Yes

Other Names:

MFCD11501250

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) 2.50 5.5 -10.92 1 7 0 71 363.458 8
Mid Mid (pH 6-8) 2.50 7.7 -50.69 2 7 1 72 364.466 8

Activity (Go SEA)

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