UCSF

ZINC19914617

Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2008 17 Yes

Other Names:

MFCD11143620

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) 2.59 6.34 -34.59 2 2 1 20 233.379 4
Mid Mid (pH 6-8) 2.59 7.58 -35.08 2 2 1 16 233.379 4

Activity (Go SEA)

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