UCSF

ZINC18176037

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2008 30 No

Other Names:

MFCD03082118

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) 7.27 13.49 -7.28 0 4 0 44 418.562 6
Ref Reference (pH 7) 7.27 14.24 -6.9 0 4 0 44 418.562 6

Activity (Go SEA)

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