UCSF

ZINC09521401

Substance Information

In ZINC since Heavy atoms Benign functionality
August 29th, 2007 21 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) 3.39 6.17 -39.52 0 6 -1 90 316.753 3
Lo Low (pH 4.5-6) 2.93 7.27 -16.09 1 6 0 87 317.761 3

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