UCSF

ZINC34323705

Substance Information

In ZINC since Heavy atoms Benign functionality
August 23rd, 2009 26 No

Other Names:

MFCD00149253

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) -4.07 -7.29 -246.58 4 15 -3 247 417.136 6
Mid Mid (pH 6-8) -4.07 -8.45 -126.13 5 15 -2 244 418.144 6

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.