UCSF

ZINC38531491

Substance Information

In ZINC since Heavy atoms Benign functionality
January 26th, 2010 11 Yes

Other Names:

MFCD01631210

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) -0.18 2.29 -49.26 3 2 1 40 147.201 1
Mid Mid (pH 6-8) -0.18 1.89 -6.23 2 2 0 38 146.193 1

Activity (Go SEA)

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