UCSF

ZINC26977303

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2009 29 No

Other Names:

MFCD20274770

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) 0.80 -3.2 -66.81 4 9 -1 149 407.395 5
Lo Low (pH 4.5-6) 0.80 -4.11 -21.84 5 9 0 146 408.403 5

Activity (Go SEA)

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