UCSF

ZINC19832160

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2008 38 Yes

Other Names:

MFCD02371507

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) 1.92 6.42 -15.82 0 10 0 84 522.602 7
Mid Mid (pH 6-8) 1.92 8.75 -58.53 1 10 1 85 523.61 7

Activity (Go SEA)

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