UCSF

ZINC19938306

Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2008 38 No

Other Names:

MFCD03696000

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) 3.70 9.85 -61.95 0 8 -1 85 518.634 11
Mid Mid (pH 6-8) 3.70 12.18 -81.84 1 8 0 87 519.642 11

Activity (Go SEA)

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