UCSF

ZINC56894754

Substance Information

In ZINC since Heavy atoms Benign functionality
January 11th, 2011 14 Yes

Other Names:

MFCD19301821

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) 1.95 4.45 -35.97 2 2 1 20 191.298 2
Hi High (pH 8-9.5) 1.95 3.32 -1.93 1 2 0 15 190.29 2

Activity (Go SEA)

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