UCSF

ZINC26012917

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 3rd, 2009 16 Yes

Popular Name: (+-)-10,11-Dihydro-5H-dibenzo(a,d)cyclohepten-5,10-imine; 5H-Dibenzo(a,d)cyclohepten-5,10-imine, 10,11-dihydro-, (+-)-; LS-60777; dl-10,11-Dihydro-5,10-imino-(5H)-dibenzo(a,d)cycloheptene (+-)-10,11-Dihydro-5H-dibenzo(a,…

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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) 3.04 6.13 -4.23 1 1 0 12 207.276 0 ↓
Mid Mid (pH 6-8) 3.04 7.5 -40.52 2 1 1 17 208.284 0 ↓

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
NMDZ1-2-E Glutamate (NMDA) Receptor Subunit Zeta 1 (cluster #2 Of 6), Eukaryotic Eukaryotes 120 0.61 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
NMDZ1_RAT P35439 Glutamate (NMDA) Receptor Subunit Zeta 1, Rat 120 0.61 Binding ≤ 1μM
NMDZ1_RAT P35439 Glutamate (NMDA) Receptor Subunit Zeta 1, Rat 120 0.61 Binding ≤ 10μM

Reactome Annotations from Targets (via Uniprot)

Description Species
CREB phosphorylation through the activation of CaMKII
EPHB-mediated forward signaling
Ras activation uopn Ca2+ infux through NMDA receptor
Unblocking of NMDA receptor, glutamate binding and activation

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