UCSF

ZINC24987214

Substance Information

In ZINC since Heavy atoms Benign functionality
January 23rd, 2009 32 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.23 1.3 -60.72 3 9 -1 141 437.476 8
Mid Mid (pH 6-8) 2.23 1.8 -61.88 4 9 0 143 438.484 8

Activity (Go SEA)

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