UCSF

ZINC01423071

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 17th, 2004 30 No

Popular Name: (4S)-2-amino-2',5-diketo-1'-methyl-1-phenyl-spiro[7,8-dihydro-6H-quinoline-4,3'-indoline]-3-carbonit (4S)-2-amino-2',5-diketo-1'-meth…

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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) 2.17 2.13 -23.66 2 6 0 90 396.45 1 ↓
Ref Reference (pH 7) 2.92 10.24 -53.67 2 6 -1 96 395.442 1 ↓

Activity (Go SEA)

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