UCSF

ZINC04060668

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2005 28 No

Other Names:

MFCD00770916

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 5.02 1.26 -7.83 0 5 0 64 383.488 6
Mid Mid (pH 6-8) 5.20 0.27 -8.62 0 5 0 64 383.488 6
Mid Mid (pH 6-8) 5.02 1.19 -10.87 0 5 0 64 383.488 6

Activity (Go SEA)

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