UCSF

ZINC15934941

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2008 34 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) 3.43 6.21 -58.07 0 8 -1 91 504.346 6
Mid Mid (pH 6-8) 3.43 8.47 -69.44 1 8 0 93 505.354 6

Activity (Go SEA)

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