UCSF

ZINC66123610

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 19th, 2011 37 No

Popular Name: (6aS,10S,10aS,11aR)-1,10-bis(dimethylamino)-4,6,6a,9-tetrahydroxy-5,7-dioxo-3-(propylamino)-10a,11,1 (6aS,10S,10aS,11aR)-1,10-bis(dim…

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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) -0.30 3.24 -70.51 6 12 -1 196 514.559 6 ↓
Hi High (pH 8-9.5) -0.30 1.89 -53.23 6 12 -1 192 514.559 6 ↓
Hi High (pH 8-9.5) -0.30 2.86 -107 5 12 -2 195 513.551 6 ↓
Mid Mid (pH 6-8) -0.30 5.14 -68.42 7 12 0 198 515.567 6 ↓
Lo Low (pH 4.5-6) -0.30 3.79 -53.41 7 12 0 194 515.567 6 ↓

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

No pre-computed analogs available. Try a structural similarity search.