UCSF

ZINC22583772

Substance Information

In ZINC since Heavy atoms Benign functionality
December 18th, 2008 23 Yes

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Annotations

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) 4.05 7.93 -18.1 1 4 0 51 334.347 4
Hi High (pH 8-9.5) 4.12 7.03 -40.17 0 4 -1 58 333.339 4

Activity (Go SEA)

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