UCSF

ZINC09674469

Substance Information

In ZINC since Heavy atoms Benign functionality
September 6th, 2007 29 No

Other Names:

MFCD14749740

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) 3.16 6.04 -12.55 1 8 0 94 432.267 4
Ref Reference (pH 7) 3.16 5.71 -10.62 1 8 0 94 432.267 4
Ref Reference (pH 7) 3.16 6.7 -18.83 1 8 0 94 432.267 4

Activity (Go SEA)

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