UCSF

ZINC13399997

Substance Information

In ZINC since Heavy atoms Benign functionality
June 18th, 2008 30 No

Other Names:

MFCD00613711

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) 5.05 11.95 -18.61 1 6 0 72 411.49 4
Ref Reference (pH 7) 5.05 12 -14.24 1 6 0 72 411.49 4

Activity (Go SEA)

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