UCSF

ZINC33920059

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 1st, 2009 34 No

Popular Name: (1R,3S,3aS,6aS)-5-(2-anilinoethyl)-4,6-dioxo-3-(4-phenylphenyl)-2,3,3a,6a-tetrahydro-1H-pyrrolo[3,4- (1R,3S,3aS,6aS)-5-(2-anilinoethy…

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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) 1.87 11.21 -45.76 3 7 0 106 455.514 7 ↓
Mid Mid (pH 6-8) 1.87 10.28 -53.47 2 7 -1 102 454.506 7 ↓

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