UCSF

ZINC32266856

Substance Information

In ZINC since Heavy atoms Benign functionality
April 26th, 2009 20 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) 4.11 9.53 -53.01 0 3 -1 53 262.288 2
Lo Low (pH 4.5-6) 4.11 9.89 -53.89 1 3 0 54 263.296 2

Activity (Go SEA)

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