UCSF

ZINC00160844

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 16 No

Other Names:

MFCD00179682

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) 1.48 2.32 -6.77 1 4 0 63 212.208 0
Hi High (pH 8-9.5) 1.94 -0.23 -44.16 0 4 -1 66 211.2 0

Activity (Go SEA)

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