UCSF

ZINC34318998

Substance Information

In ZINC since Heavy atoms Benign functionality
August 23rd, 2009 12 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) -4.31 -3.26 -61.05 4 6 -1 128 196.119 4
Hi High (pH 8-9.5) -4.31 -3.57 -96.14 3 6 -2 127 195.111 4

Activity (Go SEA)

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