UCSF

ZINC36218200

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 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) 4.10 9.95 -9.82 1 3 0 32 310.441 7
Lo Low (pH 4.5-6) 4.10 10.73 -21.8 2 3 0 34 311.449 7

Activity (Go SEA)

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