UCSF

ZINC24334238

Substance Information

In ZINC since Heavy atoms Benign functionality
January 15th, 2009 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) 3.73 8.67 -59.31 0 7 -1 86 459.522 7
Mid Mid (pH 6-8) 3.73 11.01 -66.88 1 7 0 87 460.53 7

Activity (Go SEA)

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