UCSF

ZINC32837523

Substance Information

In ZINC since Heavy atoms Benign functionality
May 10th, 2009 33 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 3.00 10.12 -55.19 1 7 1 59 447.559 6
Mid Mid (pH 6-8) 3.00 7.77 -12.91 0 7 0 58 446.551 6

Activity (Go SEA)

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