UCSF

ZINC13548723

Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2008 28 No

Other Names:

MFCD00658978

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) 7.50 13.21 -10.68 1 4 0 58 429.328 3
Ref Reference (pH 7) 7.50 13.01 -11.06 1 4 0 58 429.328 3

Activity (Go SEA)

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