UCSF

ZINC15321465

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2008 31 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) 1.67 6.53 -12.28 1 7 0 73 422.46 3
Ref Reference (pH 7) 1.67 6.29 -14.91 1 7 0 73 422.46 3
Mid Mid (pH 6-8) 1.67 8.72 -50.11 2 7 1 74 423.468 3

Activity (Go SEA)

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