UCSF

ZINC40435114

Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2010 37 Yes

Other Names:

MFCD04114304

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) 5.55 16 -17.93 0 9 0 114 504.491 12

Vendor Notes

Note Type Comments Provided By
MP 130 TCI

Activity (Go SEA)

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