UCSF

ZINC44220780

Substance Information

In ZINC since Heavy atoms Benign functionality
May 23rd, 2010 14 No

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Annotations

Vendors

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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) 1.72 1.18 -50.83 2 4 -1 81 193.178 2
Mid Mid (pH 6-8) 1.72 -0.83 -9.09 3 4 0 78 194.186 2

Activity (Go SEA)

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