UCSF

ZINC22913747

Substance Information

In ZINC since Heavy atoms Benign functionality
December 22nd, 2008 23 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) 2.27 8.35 -36.97 1 4 1 30 314.453 9
Hi High (pH 8-9.5) 2.27 6 -5.12 0 4 0 29 313.445 9
Mid Mid (pH 6-8) 2.27 8.56 -38.73 1 4 1 30 314.453 9
Lo Low (pH 4.5-6) 2.27 9 -91.1 2 4 2 31 315.461 9

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