UCSF

ZINC32099260

Substance Information

In ZINC since Heavy atoms Benign functionality
April 23rd, 2009 13 Yes

Other Names:

MFCD09787532

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) 3.10 6.95 -6.57 0 1 0 13 171.243 0
Mid Mid (pH 6-8) 3.10 7.24 -26.12 1 1 1 14 172.251 0

Activity (Go SEA)

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