UCSF

ZINC45356574

Substance Information

In ZINC since Heavy atoms Benign functionality
July 29th, 2010 29 Yes

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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) 4.32 11.56 -43.31 2 5 1 54 386.475 4
Hi High (pH 8-9.5) 4.77 6.71 -53.45 0 5 -1 56 384.459 4
Mid Mid (pH 6-8) 4.32 9.35 -12.01 1 5 0 52 385.467 4

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