UCSF

ZINC36047779

Substance Information

In ZINC since Heavy atoms Benign functionality
October 21st, 2009 14 Yes

Other Names:

MFCD13176490

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) 0.18 1.47 -86.2 4 5 0 97 194.19 3
Hi High (pH 8-9.5) 0.18 1.07 -64.64 3 5 -1 95 193.182 3

Activity (Go SEA)

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