UCSF

ZINC15935523

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2008 32 No

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) 3.13 9.18 -32.71 4 11 1 142 440.532 12
Mid Mid (pH 6-8) 3.13 6.99 -9.49 3 11 0 140 439.524 12

Activity (Go SEA)

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