UCSF

ZINC00718595

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 29 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) 3.10 3.96 -10.03 3 7 0 106 392.39 4
Lo Low (pH 4.5-6) 3.10 4.21 -56.11 4 7 1 108 393.398 4

Activity (Go SEA)

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