UCSF

ZINC15781703

Substance Information

In ZINC since Heavy atoms Benign functionality
July 30th, 2008 11 No

Other Names:

MFCD06637577

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) 1.63 4.56 -6.4 0 4 0 59 152.153 1
Lo Low (pH 4.5-6) 1.63 4.84 -39.45 1 4 1 60 153.161 1

Activity (Go SEA)

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