UCSF

ZINC36237524

Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2009 23 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) 3.23 7.27 -44.09 1 6 0 77 312.325 4
Mid Mid (pH 6-8) 3.23 6.62 -69.12 0 6 -1 76 311.317 4

Activity (Go SEA)

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