UCSF

ZINC18136709

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2008 23 No

Other Names:

MFCD00398551

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) 1.49 0.98 -9.61 3 7 0 106 312.329 3
Lo Low (pH 4.5-6) 1.49 1.3 -55.47 4 7 1 108 313.337 3

Activity (Go SEA)

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