UCSF

ZINC32250375

Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2009 14 Yes

Other Names:

MFCD00129046

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) 0.70 2.66 -5.17 0 3 0 25 192.262 3
Mid Mid (pH 6-8) 0.70 4.93 -42.66 1 3 1 27 193.27 3

Activity (Go SEA)

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