UCSF

ZINC34599469

Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2009 13 Yes

Other Names:

MFCD20492154

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) 0.32 2.89 -39.87 1 4 1 34 185.247 3
Mid Mid (pH 6-8) 0.32 0.44 -5.09 0 4 0 33 184.239 3

Activity (Go SEA)

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