UCSF

ZINC32101799

Substance Information

In ZINC since Heavy atoms Benign functionality
April 23rd, 2009 17 Yes

Other Names:

MFCD11920519

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) 0.99 2.54 -52 3 5 1 66 245.343 4
Hi High (pH 8-9.5) 0.99 1.33 -7.43 2 5 0 62 244.335 4

Activity (Go SEA)

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